#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hk9 s ILE 3 N 0.00 3.72 -1.18 -1.33 1.01 -1.26 -4.97 121.20 117.19 3hk9 s ILE 3 Ca 0.00 -2.05 0.17 0.00 0.00 0.00 0.00 60.65 58.78 3hk9 s ILE 3 Cb 0.00 -3.49 0.69 0.00 0.01 0.00 0.00 42.46 39.67 3hk9 s ILE 3 CO 0.00 -0.75 1.59 -0.46 0.00 0.00 0.00 174.94 175.32 3hk9 n ASN 4 N 4.60 4.56 -3.75 3.58 6.94 -1.26 -4.93 115.26 125.01 3hk9 n ASN 4 Ca -0.03 -2.42 -0.13 0.00 -0.02 0.00 0.00 54.58 51.97 3hk9 n ASN 4 Cb 0.41 -0.57 -0.10 0.00 -2.36 0.00 0.00 39.78 37.16 3hk9 n ASN 4 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3hk9 s SER 5 N -0.87 -0.31 0.47 0.53 1.04 -1.26 -5.03 113.70 108.28 3hk9 s SER 5 Ca 0.49 0.48 0.12 0.00 0.48 0.00 0.00 55.95 57.52 3hk9 s SER 5 Cb 0.31 0.57 1.10 0.00 0.10 0.00 0.00 66.02 68.10 3hk9 s SER 5 CO 0.24 -0.25 2.11 -0.09 0.98 0.00 0.00 173.24 176.22 3hk9 h ARG 6 N 4.90 0.23 -0.55 4.02 2.43 -1.99 -1.75 114.38 121.68 3hk9 h ARG 6 Ca -0.28 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 58.83 3hk9 h ARG 6 Cb 1.18 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 3hk9 h ARG 6 CO 0.33 0.15 0.16 0.93 -1.51 0.00 0.00 179.97 180.03 3hk9 h GLU 7 N 0.24 0.86 -0.08 0.20 3.07 -1.99 0.09 114.58 116.97 3hk9 h GLU 7 Ca 0.07 -0.19 -0.22 0.00 -0.50 0.00 0.00 59.36 58.52 3hk9 h GLU 7 Cb -0.01 -0.12 0.01 0.00 -0.84 0.00 0.00 28.75 27.79 3hk9 h GLU 7 CO -0.01 0.80 -0.83 -0.39 -1.40 0.00 0.00 179.01 177.17 3hk9 h VAL 8 N 0.77 1.33 -0.53 3.13 -1.51 -1.88 -2.71 116.25 114.85 3hk9 h VAL 8 Ca 0.18 -2.15 0.06 0.00 -1.23 0.00 0.00 66.70 63.55 3hk9 h VAL 8 Cb 0.30 2.16 -0.05 0.00 -2.13 0.00 0.00 31.29 31.57 3hk9 h VAL 8 CO -0.00 0.66 0.23 0.25 -1.23 0.00 0.00 177.57 177.48 3hk9 h LEU 9 N 0.38 0.29 -0.71 4.19 5.85 -1.17 0.21 115.31 124.36 3hk9 h LEU 9 Ca -0.06 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.72 3hk9 h LEU 9 Cb 1.45 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.44 3hk9 h LEU 9 CO 0.16 0.20 0.46 0.00 -0.34 0.00 0.00 178.44 178.92 3hk9 h ALA 10 N 1.32 0.90 -0.60 1.25 0.00 -0.89 0.94 119.26 122.19 3hk9 h ALA 10 Ca 0.25 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 3hk9 h ALA 10 Cb 0.22 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3hk9 h ALA 10 CO -0.21 0.29 0.08 1.49 0.00 0.00 0.00 179.25 180.90 3hk9 h GLU 11 N 0.93 1.00 -0.48 0.00 4.81 -1.02 -1.18 114.58 118.65 3hk9 h GLU 11 Ca 0.27 -0.28 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 3hk9 h GLU 11 Cb -0.08 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 3hk9 h GLU 11 CO -0.07 0.95 -0.22 0.87 -0.73 0.00 0.00 179.01 179.82 3hk9 h LYS 12 N 0.90 0.98 -0.40 1.92 1.57 -0.48 -1.67 116.57 119.38 3hk9 h LYS 12 Ca 0.18 -0.41 -0.09 0.00 -1.87 0.00 0.00 60.65 58.45 3hk9 h LYS 12 Cb 0.45 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 3hk9 h LYS 12 CO 0.02 1.09 -0.10 0.28 -0.57 0.00 0.00 179.45 180.16 3hk9 h VAL 13 N 0.84 1.28 -0.60 0.50 2.07 -0.69 -1.41 116.25 118.24 3hk9 h VAL 13 Ca 0.11 -1.19 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 3hk9 h VAL 13 Cb 0.79 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 3hk9 h VAL 13 CO 0.07 0.40 0.37 0.11 0.02 0.00 0.00 177.57 178.53 3hk9 h LYS 14 N 0.58 0.82 -0.24 1.57 1.57 -1.11 0.58 116.57 120.34 3hk9 h LYS 14 Ca 0.10 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 3hk9 h LYS 14 Cb 0.62 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 3hk9 h LYS 14 CO 0.04 0.58 0.09 -0.91 -0.57 0.00 0.00 179.45 178.68 3hk9 h ASN 15 N 0.82 0.34 0.02 0.86 2.35 -1.23 0.09 115.58 118.82 3hk9 h ASN 15 Ca 0.22 -0.18 0.02 0.00 -0.55 0.00 0.00 56.30 55.81 3hk9 h ASN 15 Cb -0.03 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.23 3hk9 h ASN 15 CO -0.04 0.42 -0.15 0.00 -1.65 0.00 0.00 177.43 176.01 3hk9 h ALA 16 N 0.93 -0.20 -0.43 -0.83 0.00 -0.90 0.26 119.26 118.08 3hk9 h ALA 16 Ca 0.08 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3hk9 h ALA 16 Cb 0.20 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3hk9 h ALA 16 CO -0.01 -0.65 0.24 0.28 0.00 0.00 0.00 179.25 179.12 3hk9 h VAL 17 N -0.26 1.02 -0.44 0.00 2.07 -0.77 -1.18 116.25 116.69 3hk9 h VAL 17 Ca 0.04 -0.17 -0.10 0.00 0.82 0.00 0.00 66.70 67.29 3hk9 h VAL 17 Cb 0.32 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3hk9 h VAL 17 CO -0.13 0.09 -0.15 0.78 0.02 0.00 0.00 177.57 178.18 3hk9 h ASN 18 N 0.49 0.82 1.85 0.57 -0.26 -0.75 -3.14 115.58 115.17 3hk9 h ASN 18 Ca 0.18 -0.27 0.00 0.00 -0.56 0.00 0.00 56.30 55.65 3hk9 h ASN 18 Cb 0.03 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 37.07 3hk9 h ASN 18 CO -0.09 0.98 0.00 0.78 -1.06 0.00 0.00 177.43 178.03 3hk9 h ASN 19 N 0.73 0.00 -2.64 5.81 2.35 -0.73 -3.46 115.58 117.65 3hk9 h ASN 19 Ca 0.11 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.31 3hk9 h ASN 19 Cb 0.66 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.01 3hk9 h ASN 19 CO 0.05 0.00 1.10 -1.58 -1.65 0.00 0.00 177.43 175.34 3hk9 s GLN 20 N -3.25 4.09 0.29 0.81 2.00 -0.46 -4.96 119.66 118.17 3hk9 s GLN 20 Ca 0.07 2.06 -0.30 0.00 -2.00 0.00 0.00 55.36 55.19 3hk9 s GLN 20 Cb 0.06 -3.99 -0.11 0.00 0.80 0.00 0.00 33.01 29.77 3hk9 s GLN 20 CO 0.65 -0.95 1.52 -2.14 -0.50 0.00 0.00 175.29 173.87 3hk9 s PRO 21 N 4.18 4.18 -0.13 1.67 0.02 -1.26 -4.93 135.00 138.73 3hk9 s PRO 21 Ca 0.73 2.47 -0.07 0.00 0.02 0.00 0.00 61.00 64.14 3hk9 s PRO 21 Cb -0.31 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.12 3hk9 s PRO 21 CO 0.29 -0.54 0.14 0.08 -0.33 0.00 0.00 177.00 176.64 3hk9 s VAL 22 N -0.14 5.50 -0.31 3.83 1.01 0.04 -4.63 120.40 125.70 3hk9 s VAL 22 Ca 0.60 0.21 -0.08 0.00 0.00 0.00 0.00 61.98 62.71 3hk9 s VAL 22 Cb -0.45 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.53 3hk9 s VAL 22 CO 0.48 0.61 0.11 -0.89 0.00 0.00 0.00 175.10 175.41 3hk9 s THR 23 N -0.92 4.14 -0.71 3.92 2.01 -0.49 -0.50 115.64 123.09 3hk9 s THR 23 Ca 0.14 -0.72 -0.19 0.00 0.31 0.00 0.00 61.69 61.24 3hk9 s THR 23 Cb -0.12 -3.18 0.12 0.00 0.01 0.00 0.00 72.50 69.33 3hk9 s THR 23 CO 0.04 0.00 0.83 -0.62 -0.69 0.00 0.00 174.62 174.18 3hk9 s ASP 24 N 1.51 6.36 0.00 3.53 -1.08 0.44 -4.72 116.67 122.72 3hk9 s ASP 24 Ca 0.02 -1.70 0.13 0.00 -0.52 0.00 0.00 52.55 50.48 3hk9 s ASP 24 Cb -0.18 -2.32 0.78 0.00 -1.46 0.00 0.00 42.92 39.74 3hk9 s ASP 24 CO 0.04 -1.06 1.27 1.15 0.52 0.00 0.00 175.17 177.09 3hk9 n MET 25 N 6.19 0.68 -3.28 4.34 0.00 -1.26 -1.19 117.12 122.60 3hk9 n MET 25 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 57.70 57.75 3hk9 n MET 25 Cb 0.45 -1.30 -0.02 0.00 0.00 0.00 0.00 33.22 32.35 3hk9 n MET 25 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 3hk9 s HIS 26 N -2.00 -1.39 0.32 3.17 5.65 -1.26 -4.74 115.29 115.04 3hk9 s HIS 26 Ca 0.19 1.72 -0.02 0.00 0.25 0.00 0.00 55.06 57.20 3hk9 s HIS 26 Cb 0.09 0.58 -0.00 0.00 -1.18 0.00 0.00 32.58 32.06 3hk9 s HIS 26 CO 0.15 -0.74 0.43 0.95 -0.65 0.00 0.00 174.74 174.88 3hk9 s THR 27 N 2.86 0.00 -0.26 0.89 -4.23 -0.82 -0.98 115.64 113.10 3hk9 s THR 27 Ca 0.11 -1.66 0.09 0.00 -1.18 0.00 0.00 61.69 59.06 3hk9 s THR 27 Cb -0.13 -2.57 0.45 0.00 1.34 0.00 0.00 72.50 71.58 3hk9 s THR 27 CO -0.19 0.00 1.20 1.41 -0.54 0.00 0.00 174.62 176.49 3hk9 n HIS 28 N -0.53 1.76 -3.89 3.99 8.25 0.24 -3.09 115.22 121.95 3hk9 n HIS 28 Ca 0.02 -1.95 -0.21 0.00 -0.26 0.00 0.00 57.72 55.32 3hk9 n HIS 28 Cb 0.62 -0.30 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 3hk9 n HIS 28 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3hk9 s LEU 29 N -3.41 3.91 0.06 2.41 1.43 -1.21 -4.63 118.68 117.25 3hk9 s LEU 29 Ca 0.45 -0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 3hk9 s LEU 29 Cb 0.39 -2.51 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 3hk9 s LEU 29 CO -0.00 -0.19 -0.10 -0.36 0.23 0.00 0.00 176.35 175.92 3hk9 s PHE 30 N -2.15 0.92 0.42 0.29 0.08 -1.26 -4.42 117.98 111.86 3hk9 s PHE 30 Ca 0.37 -0.53 -0.25 0.00 0.12 0.00 0.00 56.93 56.64 3hk9 s PHE 30 Cb -0.08 -0.53 -0.10 0.00 -0.57 0.00 0.00 43.02 41.74 3hk9 s PHE 30 CO 0.27 -0.03 1.24 0.45 -0.10 0.00 0.00 175.22 177.06 3hk9 n SER 31 N 1.20 2.39 -0.35 1.36 2.88 -1.26 -4.77 113.62 115.07 3hk9 n SER 31 Ca -0.21 1.10 0.16 0.00 -1.33 0.00 0.00 58.87 58.59 3hk9 n SER 31 Cb 0.55 -1.48 0.37 0.00 -0.75 0.00 0.00 64.21 62.90 3hk9 n SER 31 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3hk9 h PRO 32 N 2.02 0.64 0.00 -1.46 0.11 -1.94 -1.16 132.00 130.21 3hk9 h PRO 32 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3hk9 h PRO 32 Cb 1.30 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3hk9 h PRO 32 CO 0.60 0.42 0.00 0.27 -0.21 0.00 0.00 178.00 179.08 3hk9 n ASN 33 N -4.80 0.00 0.00 -2.05 6.94 -1.26 -2.23 115.26 111.86 3hk9 n ASN 33 Ca 0.25 0.41 0.12 0.00 -0.02 0.00 0.00 54.58 55.34 3hk9 n ASN 33 Cb 0.67 -0.44 0.57 0.00 -2.36 0.00 0.00 39.78 38.22 3hk9 n ASN 33 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3hk9 n PHE 34 N -1.44 0.00 -0.97 -2.53 3.01 -0.44 -5.02 117.46 110.07 3hk9 n PHE 34 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 3hk9 n PHE 34 Cb 0.10 -0.42 0.00 0.00 -0.01 0.00 0.00 39.48 39.14 3hk9 n PHE 34 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hk9 n GLY 35 N 1.01 -1.44 0.00 1.37 0.00 -0.95 -4.32 105.19 100.85 3hk9 n GLY 35 Ca 0.08 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.31 3hk9 n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hk9 n GLU 36 N 0.00 0.00 0.24 1.61 -0.58 -1.26 -1.82 120.64 118.83 3hk9 n GLU 36 Ca 0.00 0.32 0.07 0.00 -0.42 0.00 0.00 57.16 57.14 3hk9 n GLU 36 Cb 0.00 -1.50 0.57 0.00 -0.57 0.00 0.00 31.44 29.94 3hk9 n GLU 36 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 3hk9 h ILE 37 N 0.00 1.00 -3.35 -3.67 2.10 -1.96 -3.38 117.51 108.24 3hk9 h ILE 37 Ca 0.00 -0.55 -0.58 0.00 1.08 0.00 0.00 64.86 64.82 3hk9 h ILE 37 Cb 0.00 1.30 -0.07 0.00 -1.09 0.00 0.00 36.82 36.97 3hk9 h ILE 37 CO 0.00 0.15 0.78 -0.22 -1.08 0.00 0.00 178.15 177.78 3hk9 s LEU 38 N -8.38 3.94 0.08 2.19 2.96 -0.76 -4.79 118.68 113.93 3hk9 s LEU 38 Ca -0.04 0.95 -0.14 0.00 -0.22 0.00 0.00 54.13 54.68 3hk9 s LEU 38 Cb 0.15 -3.47 -0.06 0.00 0.50 0.00 0.00 46.19 43.31 3hk9 s LEU 38 CO 0.67 -0.86 0.48 -0.76 -1.32 0.00 0.00 176.35 174.56 3hk9 s LEU 39 N 3.59 4.40 -0.00 -0.68 1.43 -1.26 -5.02 118.68 121.14 3hk9 s LEU 39 Ca 0.44 1.00 -0.29 0.00 -1.03 0.00 0.00 54.13 54.25 3hk9 s LEU 39 Cb -0.12 -2.98 0.10 0.00 0.03 0.00 0.00 46.19 43.22 3hk9 s LEU 39 CO 0.16 0.20 0.89 -1.66 0.23 0.00 0.00 176.35 176.17 3hk9 s TRP 40 N -1.31 -0.34 0.00 0.29 1.48 -1.26 -1.14 118.94 116.67 3hk9 s TRP 40 Ca 0.32 0.20 0.00 0.00 -1.06 0.00 0.00 56.10 55.56 3hk9 s TRP 40 Cb -0.16 0.54 0.00 0.00 -1.16 0.00 0.00 33.47 32.69 3hk9 s TRP 40 CO 0.17 -0.54 0.00 -0.40 -4.06 0.00 0.00 176.95 172.12 3hk9 n ASP 41 N -0.25 0.00 -0.03 -2.66 5.68 -1.26 -4.58 116.55 113.45 3hk9 n ASP 41 Ca -0.09 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.32 3hk9 n ASP 41 Cb 0.62 0.00 0.53 0.00 -1.14 0.00 0.00 41.12 41.13 3hk9 n ASP 41 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3hk9 h ILE 42 N 0.00 0.90 -0.14 2.12 6.09 -1.95 -1.17 117.51 123.35 3hk9 h ILE 42 Ca 0.00 -0.11 -0.12 0.00 -1.37 0.00 0.00 64.86 63.26 3hk9 h ILE 42 Cb 0.00 0.55 -0.01 0.00 0.47 0.00 0.00 36.82 37.83 3hk9 h ILE 42 CO 0.00 0.06 -0.44 0.44 -3.07 0.00 0.00 178.15 175.14 3hk9 h ASP 43 N 0.32 0.36 0.25 2.19 3.32 -1.95 -1.16 116.42 119.75 3hk9 h ASP 43 Ca 0.24 -0.16 -0.17 0.00 0.02 0.00 0.00 57.03 56.95 3hk9 h ASP 43 Cb 0.50 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3hk9 h ASP 43 CO -0.05 0.76 -0.69 -0.33 -1.72 0.00 0.00 179.24 177.21 3hk9 h GLU 44 N 0.28 0.40 -0.46 3.56 4.39 -1.51 -2.57 114.58 118.67 3hk9 h GLU 44 Ca 0.02 -0.31 -0.06 0.00 0.34 0.00 0.00 59.36 59.36 3hk9 h GLU 44 Cb 0.89 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.58 3hk9 h GLU 44 CO 0.07 0.94 0.06 -0.07 -1.16 0.00 0.00 179.01 178.85 3hk9 h LEU 45 N 0.28 0.74 -1.08 1.33 3.38 -0.94 -2.78 115.31 116.24 3hk9 h LEU 45 Ca -0.02 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 3hk9 h LEU 45 Cb 1.25 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 3hk9 h LEU 45 CO 0.12 0.82 -0.08 -0.07 0.09 0.00 0.00 178.44 179.32 3hk9 h LEU 46 N 0.63 0.00 -3.12 1.67 3.38 -1.19 -3.03 115.31 113.66 3hk9 h LEU 46 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3hk9 h LEU 46 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3hk9 h LEU 46 CO 0.01 0.08 0.00 0.35 0.09 0.00 0.00 178.44 178.97 3hk9 n THR 47 N -3.18 1.77 -1.65 0.22 -2.24 -0.97 -4.73 114.28 103.50 3hk9 n THR 47 Ca 0.01 -1.25 -0.44 0.00 -2.27 0.00 0.00 64.05 60.10 3hk9 n THR 47 Cb 0.39 0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.74 3hk9 n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hk9 n TYR 48 N 0.89 1.91 0.28 4.78 9.36 -1.06 -4.74 117.16 128.58 3hk9 n TYR 48 Ca 0.24 0.56 0.18 0.00 3.32 0.00 0.00 57.90 62.21 3hk9 n TYR 48 Cb 0.83 -2.38 0.96 0.00 -0.63 0.00 0.00 39.34 38.13 3hk9 n TYR 48 CO 0.00 0.00 0.00 1.12 0.22 0.00 0.00 176.86 178.20 3hk9 h HIS 49 N 3.00 0.00 -0.97 2.98 2.07 -1.92 -0.11 115.15 120.20 3hk9 h HIS 49 Ca -0.44 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.08 3hk9 h HIS 49 Cb 1.30 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 31.23 3hk9 h HIS 49 CO 0.52 0.00 0.60 1.88 -3.07 0.00 0.00 177.93 177.86 3hk9 h TYR 50 N 0.00 1.26 0.00 6.12 -1.99 -1.94 -2.17 116.97 118.25 3hk9 h TYR 50 Ca 0.03 0.01 -0.07 0.00 2.00 0.00 0.00 58.73 60.70 3hk9 h TYR 50 Cb 0.32 -0.42 -0.01 0.00 2.00 0.00 0.00 36.73 38.62 3hk9 h TYR 50 CO 0.00 0.82 -0.34 -0.07 -0.00 0.00 0.00 178.16 178.57 3hk9 h LEU 51 N 1.33 0.00 -0.23 3.88 3.38 -1.32 -2.67 115.31 119.69 3hk9 h LEU 51 Ca 0.35 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.25 3hk9 h LEU 51 Cb -0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3hk9 h LEU 51 CO -0.07 0.34 -0.14 0.58 0.09 0.00 0.00 178.44 179.25 3hk9 h VAL 52 N 0.00 1.31 -0.54 1.22 2.07 -1.22 0.99 116.25 120.08 3hk9 h VAL 52 Ca -0.00 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.28 3hk9 h VAL 52 Cb 1.09 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.46 3hk9 h VAL 52 CO 0.04 0.38 0.35 0.00 0.02 0.00 0.00 177.57 178.36 3hk9 h ALA 53 N 0.70 0.68 -0.59 1.67 0.00 -1.40 -2.21 119.26 118.11 3hk9 h ALA 53 Ca 0.05 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 3hk9 h ALA 53 Cb 0.65 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3hk9 h ALA 53 CO 0.04 0.14 -0.02 0.93 0.00 0.00 0.00 179.25 180.33 3hk9 h GLU 54 N 0.73 1.06 -0.14 0.00 5.08 -1.33 -3.01 114.58 116.96 3hk9 h GLU 54 Ca 0.20 -0.35 -0.10 0.00 -1.00 0.00 0.00 59.36 58.11 3hk9 h GLU 54 Cb -0.06 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 3hk9 h GLU 54 CO -0.04 1.04 -0.35 -0.24 -1.00 0.00 0.00 179.01 178.42 3hk9 h VAL 55 N 0.96 1.29 0.00 3.13 3.04 -0.60 -2.75 116.25 121.31 3hk9 h VAL 55 Ca 0.17 -1.40 0.00 0.00 -1.01 0.00 0.00 66.70 64.45 3hk9 h VAL 55 Cb 0.58 1.57 0.00 0.00 -2.01 0.00 0.00 31.29 31.44 3hk9 h VAL 55 CO 0.03 0.43 0.00 0.24 -1.01 0.00 0.00 177.57 177.26 3hk9 h MET 56 N 0.25 0.00 0.00 4.17 2.86 -1.26 -0.47 114.93 120.48 3hk9 h MET 56 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 3hk9 h MET 56 Cb 0.75 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.41 3hk9 h MET 56 CO 0.06 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.03 3hk9 h ARG 57 N 0.00 0.00 0.00 1.72 3.08 -1.51 -3.39 114.38 114.28 3hk9 h ARG 57 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 3hk9 h ARG 57 Cb 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 3hk9 h ARG 57 CO 0.00 0.00 -1.16 0.91 -1.07 0.00 0.00 179.97 178.65 3hk9 n TRP 58 N -2.37 0.00 -1.68 3.04 7.02 -0.46 -5.09 117.44 117.90 3hk9 n TRP 58 Ca 0.05 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 56.16 3hk9 n TRP 58 Cb 0.44 -0.26 0.07 0.00 -2.42 0.00 0.00 31.31 29.14 3hk9 n TRP 58 CO 0.00 0.00 0.00 -2.37 -2.02 0.00 0.00 177.69 173.30 3hk9 n THR 59 N -3.47 4.53 1.05 -0.99 5.66 -0.31 -4.94 114.28 115.80 3hk9 n THR 59 Ca -0.13 -0.49 0.12 0.00 -3.05 0.00 0.00 64.05 60.50 3hk9 n THR 59 Cb 0.50 -1.37 0.31 0.00 -1.55 0.00 0.00 70.33 68.22 3hk9 n THR 59 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 3hk9 n ASP 60 N -1.60 0.53 -4.68 1.09 10.43 -1.26 -4.86 116.55 116.21 3hk9 n ASP 60 Ca 0.15 -0.29 -0.42 0.00 2.57 0.00 0.00 54.79 56.80 3hk9 n ASP 60 Cb 0.48 0.16 -0.03 0.00 1.84 0.00 0.00 41.12 43.58 3hk9 n ASP 60 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3hk9 s VAL 61 N -2.91 4.09 0.70 2.53 1.01 -1.26 -5.00 120.40 119.57 3hk9 s VAL 61 Ca 0.14 1.41 -0.16 0.00 0.00 0.00 0.00 61.98 63.37 3hk9 s VAL 61 Cb 0.18 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.68 3hk9 s VAL 61 CO 0.65 -0.04 1.23 -0.94 0.00 0.00 0.00 175.10 176.00 3hk9 s SER 62 N 1.80 4.33 0.38 3.32 1.04 -1.26 -4.79 113.70 118.51 3hk9 s SER 62 Ca 0.58 2.43 0.06 0.00 0.48 0.00 0.00 55.95 59.50 3hk9 s SER 62 Cb -0.26 -2.60 0.76 0.00 0.10 0.00 0.00 66.02 64.02 3hk9 s SER 62 CO 0.22 -2.18 1.99 -0.29 0.98 0.00 0.00 173.24 173.96 3hk9 h ILE 63 N -0.03 1.14 -0.41 -1.02 6.09 -1.97 -0.39 117.51 120.93 3hk9 h ILE 63 Ca -0.49 -0.43 -0.06 0.00 -1.37 0.00 0.00 64.86 62.51 3hk9 h ILE 63 Cb 1.31 0.69 -0.01 0.00 0.47 0.00 0.00 36.82 39.27 3hk9 h ILE 63 CO 0.51 0.17 0.01 -0.33 -3.07 0.00 0.00 178.15 175.44 3hk9 h GLU 64 N 0.53 0.71 -0.68 2.19 3.07 -1.92 -1.42 114.58 117.06 3hk9 h GLU 64 Ca 0.13 -0.22 -0.05 0.00 -0.50 0.00 0.00 59.36 58.72 3hk9 h GLU 64 Cb 0.10 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 3hk9 h GLU 64 CO -0.01 0.79 0.23 0.00 -1.40 0.00 0.00 179.01 178.62 3hk9 h ALA 65 N 0.89 1.13 0.14 3.43 0.00 -1.75 -1.86 119.26 121.24 3hk9 h ALA 65 Ca 0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3hk9 h ALA 65 Cb 0.46 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3hk9 h ALA 65 CO 0.02 0.61 -0.11 0.35 0.00 0.00 0.00 179.25 180.12 3hk9 h PHE 66 N 1.00 -0.27 0.00 0.00 3.57 -0.72 -1.73 116.94 118.78 3hk9 h PHE 66 Ca 0.22 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.71 3hk9 h PHE 66 Cb 0.25 0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 3hk9 h PHE 66 CO 0.02 -0.17 -0.09 -1.49 -2.23 0.00 0.00 178.31 174.35 3hk9 h TRP 67 N -0.25 0.00 0.00 0.41 -0.00 -1.08 -1.58 115.95 113.45 3hk9 h TRP 67 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.88 3hk9 h TRP 67 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.39 3hk9 h TRP 67 CO -0.10 0.09 0.00 0.00 -0.00 0.00 0.00 178.44 178.43 3hk9 h ALA 68 N 1.91 1.00 -2.41 1.49 0.00 -0.63 -3.46 119.26 117.17 3hk9 h ALA 68 Ca -0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 3hk9 h ALA 68 Cb 0.27 0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.17 3hk9 h ALA 68 CO 0.01 0.00 0.35 -1.64 0.00 0.00 0.00 179.25 177.97 3hk9 s MET 69 N -3.20 2.24 0.66 0.00 -1.94 -0.59 -5.04 119.30 111.42 3hk9 s MET 69 Ca 0.08 0.66 -0.11 0.00 -1.71 0.00 0.00 55.69 54.61 3hk9 s MET 69 Cb 0.08 -1.93 -0.02 0.00 2.01 0.00 0.00 34.83 34.97 3hk9 s MET 69 CO 0.63 -1.52 1.06 -1.54 -0.01 0.00 0.00 175.02 173.64 3hk9 s SER 70 N -3.93 5.89 0.27 3.03 1.04 -1.26 -4.81 113.70 113.93 3hk9 s SER 70 Ca 0.60 1.28 -0.00 0.00 0.48 0.00 0.00 55.95 58.31 3hk9 s SER 70 Cb -0.14 -2.23 0.55 0.00 0.10 0.00 0.00 66.02 64.30 3hk9 s SER 70 CO 0.54 -1.07 1.77 0.50 0.98 0.00 0.00 173.24 175.96 3hk9 h LYS 71 N -0.46 0.65 -0.50 4.02 1.63 -1.96 0.56 116.57 120.50 3hk9 h LYS 71 Ca -0.44 -0.04 -0.10 0.00 -0.85 0.00 0.00 60.65 59.21 3hk9 h LYS 71 Cb 1.22 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 32.68 3hk9 h LYS 71 CO 0.63 0.43 -0.09 -0.09 -3.45 0.00 0.00 179.45 176.87 3hk9 h ARG 72 N 0.67 0.92 -0.36 1.90 2.43 -1.94 -2.29 114.38 115.71 3hk9 h ARG 72 Ca 0.48 -0.32 -0.14 0.00 -0.81 0.00 0.00 59.98 59.19 3hk9 h ARG 72 Cb 0.66 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3hk9 h ARG 72 CO -0.35 0.97 -0.32 0.93 -1.51 0.00 0.00 179.97 179.69 3hk9 h GLU 73 N 0.83 0.79 -0.63 0.20 5.08 -1.43 -1.64 114.58 117.78 3hk9 h GLU 73 Ca 0.14 -0.37 -0.07 0.00 -1.00 0.00 0.00 59.36 58.05 3hk9 h GLU 73 Cb 0.62 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 3hk9 h GLU 73 CO 0.04 1.00 0.11 1.96 -1.00 0.00 0.00 179.01 181.12 3hk9 h GLN 74 N 0.67 1.02 -0.41 2.33 4.20 -0.84 -2.10 115.11 119.97 3hk9 h GLN 74 Ca 0.07 -0.25 -0.06 0.00 0.06 0.00 0.00 58.65 58.47 3hk9 h GLN 74 Cb 0.86 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.50 3hk9 h GLN 74 CO 0.08 0.93 0.02 0.00 -0.67 0.00 0.00 178.83 179.18 3hk9 h ALA 75 N 1.15 0.55 -0.80 3.87 0.00 -1.23 -1.84 119.26 120.97 3hk9 h ALA 75 Ca 0.20 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 3hk9 h ALA 75 Cb 0.40 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3hk9 h ALA 75 CO 0.01 0.32 0.49 -0.44 0.00 0.00 0.00 179.25 179.62 3hk9 h ASP 76 N 0.55 0.95 0.07 0.00 3.32 -1.08 0.19 116.42 120.42 3hk9 h ASP 76 Ca 0.12 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 3hk9 h ASP 76 Cb 0.45 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3hk9 h ASP 76 CO 0.02 0.73 -0.03 0.25 -1.72 0.00 0.00 179.24 178.48 3hk9 h LEU 77 N 1.09 -0.08 -0.60 1.55 5.85 -1.26 -1.23 115.31 120.63 3hk9 h LEU 77 Ca 0.29 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 3hk9 h LEU 77 Cb -0.05 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 3hk9 h LEU 77 CO -0.06 0.11 0.35 0.40 -0.34 0.00 0.00 178.44 178.91 3hk9 h ILE 78 N -0.27 1.18 0.06 4.05 2.04 -1.17 0.21 117.51 123.62 3hk9 h ILE 78 Ca -0.01 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.45 3hk9 h ILE 78 Cb 0.23 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 3hk9 h ILE 78 CO 0.02 0.19 -0.14 -0.25 0.00 0.00 0.00 178.15 177.97 3hk9 h TRP 79 N 0.81 -0.35 -0.45 1.37 2.91 -0.88 0.15 115.95 119.50 3hk9 h TRP 79 Ca 0.21 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.23 3hk9 h TRP 79 Cb -0.01 0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 28.77 3hk9 h TRP 79 CO -0.02 -0.21 0.26 1.49 -1.03 0.00 0.00 178.44 178.93 3hk9 h GLU 80 N -0.26 0.62 -0.02 2.65 4.57 -0.89 -0.67 114.58 120.58 3hk9 h GLU 80 Ca 0.03 -0.07 -0.24 0.00 -1.18 0.00 0.00 59.36 57.90 3hk9 h GLU 80 Cb 0.29 -0.13 0.01 0.00 -0.16 0.00 0.00 28.75 28.77 3hk9 h GLU 80 CO -0.09 0.48 -0.97 0.93 -1.18 0.00 0.00 179.01 178.18 3hk9 h GLU 81 N 0.59 0.58 0.00 1.92 4.39 -0.39 -0.36 114.58 121.31 3hk9 h GLU 81 Ca 0.16 -0.61 -0.05 0.00 0.34 0.00 0.00 59.36 59.21 3hk9 h GLU 81 Cb 0.03 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 3hk9 h GLU 81 CO -0.03 1.22 -1.92 1.28 -1.16 0.00 0.00 179.01 178.40 3hk9 n LEU 82 N -3.82 0.12 -0.08 1.33 4.77 0.52 -3.97 117.00 115.86 3hk9 n LEU 82 Ca -0.09 0.05 -0.11 0.00 -0.03 0.00 0.00 56.01 55.83 3hk9 n LEU 82 Cb 0.85 0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.91 3hk9 n LEU 82 CO 0.53 0.04 -1.03 0.49 -1.33 0.00 0.00 177.39 176.10 3hk9 n PHE 83 N -2.38 0.00 -0.11 -1.77 3.72 -0.29 -3.19 117.46 113.45 3hk9 n PHE 83 Ca -0.07 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.11 3hk9 n PHE 83 Cb 0.64 -0.63 -0.11 0.00 -0.94 0.00 0.00 39.48 38.45 3hk9 n PHE 83 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3hk9 n ILE 84 N -2.95 1.53 0.22 4.37 2.08 -1.01 -4.24 119.36 119.36 3hk9 n ILE 84 Ca -0.28 -0.04 0.10 0.00 0.56 0.00 0.00 62.75 63.09 3hk9 n ILE 84 Cb 0.81 -2.05 0.43 0.00 -0.75 0.00 0.00 39.64 38.08 3hk9 n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3hk9 h LYS 85 N -1.00 0.00 -3.81 0.38 1.57 -1.25 -3.44 116.57 109.02 3hk9 h LYS 85 Ca -0.36 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.28 3hk9 h LYS 85 Cb 1.29 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.41 3hk9 h LYS 85 CO -0.22 0.22 -0.58 1.03 -0.57 0.00 0.00 179.45 179.33 3hk9 s ARG 86 N -3.58 0.48 0.27 3.15 3.00 -1.26 -5.07 118.95 115.94 3hk9 s ARG 86 Ca 0.01 -0.65 -0.30 0.00 0.00 0.00 0.00 55.73 54.79 3hk9 s ARG 86 Cb 0.10 0.18 -0.10 0.00 0.00 0.00 0.00 34.95 35.13 3hk9 s ARG 86 CO 0.64 -0.11 1.35 -1.12 0.00 0.00 0.00 175.30 176.06 3hk9 s SER 87 N -1.79 6.78 -1.18 0.23 0.01 -1.26 -3.58 113.70 112.91 3hk9 s SER 87 Ca -0.10 2.59 -0.11 0.00 1.31 0.00 0.00 55.95 59.65 3hk9 s SER 87 Cb -0.05 -2.63 -0.07 0.00 0.21 0.00 0.00 66.02 63.48 3hk9 s SER 87 CO -0.02 -0.58 2.35 -0.81 0.41 0.00 0.00 173.24 174.60 3hk9 n PRO 88 N 1.80 2.58 0.15 12.44 -0.04 -1.19 -4.62 135.00 146.11 3hk9 n PRO 88 Ca 0.04 -1.89 0.12 0.00 -0.04 0.00 0.00 63.50 61.72 3hk9 n PRO 88 Cb 0.42 -2.74 0.16 0.00 -0.04 0.00 0.00 33.50 31.30 3hk9 n PRO 88 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3hk9 h VAL 89 N 3.54 0.00 -4.15 0.52 -1.51 -1.89 -3.28 116.25 109.49 3hk9 h VAL 89 Ca 0.61 -0.84 -0.51 0.00 -1.23 0.00 0.00 66.70 64.73 3hk9 h VAL 89 Cb 0.34 1.65 0.19 0.00 -2.13 0.00 0.00 31.29 31.33 3hk9 h VAL 89 CO 1.69 0.00 0.21 -0.94 -1.23 0.00 0.00 177.57 177.30 3hk9 s SER 90 N -5.43 2.96 0.16 4.19 1.04 -1.26 -4.74 113.70 110.61 3hk9 s SER 90 Ca 0.05 2.02 -0.14 0.00 0.48 0.00 0.00 55.95 58.36 3hk9 s SER 90 Cb 0.09 -2.51 0.05 0.00 0.10 0.00 0.00 66.02 63.74 3hk9 s SER 90 CO 0.70 -3.05 1.78 -0.08 0.98 0.00 0.00 173.24 173.57 3hk9 h GLU 91 N -1.83 0.70 -0.59 4.02 4.57 -1.97 -0.72 114.58 118.76 3hk9 h GLU 91 Ca -0.46 -0.08 -0.09 0.00 -1.18 0.00 0.00 59.36 57.56 3hk9 h GLU 91 Cb 1.27 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.70 3hk9 h GLU 91 CO 0.45 0.53 0.02 0.00 -1.18 0.00 0.00 179.01 178.83 3hk9 h ALA 92 N 1.13 0.80 -0.08 2.92 0.00 -1.95 -0.90 119.26 121.18 3hk9 h ALA 92 Ca 0.18 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3hk9 h ALA 92 Cb 0.03 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3hk9 h ALA 92 CO -0.03 0.62 0.01 0.00 0.00 0.00 0.00 179.25 179.84 3hk9 h ARG 94 N -0.13 0.62 -0.85 0.00 2.43 -1.04 -0.22 114.38 115.19 3hk9 h ARG 94 Ca 0.02 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 3hk9 h ARG 94 Cb 0.31 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.68 3hk9 h ARG 94 CO 0.00 0.41 0.44 0.78 -1.51 0.00 0.00 179.97 180.09 3hk9 h GLY 95 N 0.64 1.28 1.22 2.80 0.00 -0.79 -1.33 103.07 106.89 3hk9 h GLY 95 Ca 0.44 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 3hk9 h GLY 95 CO -0.19 0.58 0.45 -2.08 0.00 0.00 0.00 176.54 175.30 3hk9 h VAL 96 N 1.19 1.22 -0.30 4.60 2.07 -0.68 -1.64 116.25 122.70 3hk9 h VAL 96 Ca 0.29 -0.49 -0.15 0.00 0.82 0.00 0.00 66.70 67.18 3hk9 h VAL 96 Cb 0.07 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 29.99 3hk9 h VAL 96 CO -0.04 0.23 -0.39 -0.07 0.02 0.00 0.00 177.57 177.32 3hk9 h LEU 97 N 1.05 0.86 -1.10 2.57 3.38 -1.17 -2.30 115.31 118.60 3hk9 h LEU 97 Ca 0.27 -0.50 0.01 0.00 0.09 0.00 0.00 57.88 57.76 3hk9 h LEU 97 Cb -0.03 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.43 3hk9 h LEU 97 CO -0.05 1.19 0.61 0.74 0.09 0.00 0.00 178.44 181.01 3hk9 h THR 98 N 0.56 1.23 0.03 0.22 2.02 -0.84 -1.07 112.91 115.05 3hk9 h THR 98 Ca 0.04 -0.42 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 3hk9 h THR 98 Cb 0.98 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 3hk9 h THR 98 CO 0.09 0.22 -0.02 0.00 0.37 0.00 0.00 175.52 176.19 3hk9 h LEU 100 N -0.14 -0.57 -0.46 0.00 3.38 -0.91 -1.26 115.31 115.34 3hk9 h LEU 100 Ca -0.00 0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.08 3hk9 h LEU 100 Cb 0.13 0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3hk9 h LEU 100 CO 0.01 -0.26 0.24 -0.61 0.09 0.00 0.00 178.44 177.91 3hk9 h GLN 101 N -0.31 0.46 -0.34 1.13 4.15 -1.17 -1.16 115.11 117.87 3hk9 h GLN 101 Ca 0.06 -0.03 0.07 0.00 0.77 0.00 0.00 58.65 59.52 3hk9 h GLN 101 Cb 0.39 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.96 3hk9 h GLN 101 CO -0.18 0.31 0.24 0.78 -1.93 0.00 0.00 178.83 178.04 3hk9 h GLY 102 N 0.48 0.17 0.41 2.39 0.00 -0.51 0.18 103.07 106.19 3hk9 h GLY 102 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.47 3hk9 h GLY 102 CO -0.13 0.04 0.00 1.04 0.00 0.00 0.00 176.54 177.49 3hk9 n LEU 103 N -4.46 0.46 0.00 3.11 4.77 -0.52 -4.87 117.00 115.48 3hk9 n LEU 103 Ca 0.05 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 3hk9 n LEU 103 Cb 0.32 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 3hk9 n LEU 103 CO 0.35 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 3hk9 n GLY 104 N 0.99 0.75 3.91 -0.72 0.00 0.05 -5.06 105.19 105.11 3hk9 n GLY 104 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.94 3hk9 n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hk9 s LEU 105 N 0.00 3.48 -0.40 0.99 1.43 -0.52 -5.00 118.68 118.65 3hk9 s LEU 105 Ca 0.00 0.90 -0.06 0.00 -1.03 0.00 0.00 54.13 53.94 3hk9 s LEU 105 Cb 0.00 -3.83 0.09 0.00 0.03 0.00 0.00 46.19 42.48 3hk9 s LEU 105 CO 0.00 -0.75 0.21 -0.62 0.23 0.00 0.00 176.35 175.42 3hk9 s ASP 106 N -4.17 5.40 0.51 2.29 2.15 -1.26 -3.85 116.67 117.74 3hk9 s ASP 106 Ca 0.50 -1.69 0.18 0.00 0.43 0.00 0.00 52.55 51.97 3hk9 s ASP 106 Cb -0.10 -1.89 1.29 0.00 -0.30 0.00 0.00 42.92 41.92 3hk9 s ASP 106 CO 0.46 -0.51 2.12 -0.65 -0.17 0.00 0.00 175.17 176.41 3hk9 h PRO 107 N 8.23 0.00 -0.54 4.34 0.11 -1.91 -2.84 132.00 139.38 3hk9 h PRO 107 Ca -0.19 0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.99 3hk9 h PRO 107 Cb 1.07 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 3hk9 h PRO 107 CO 0.71 0.05 0.36 0.00 -0.21 0.00 0.00 178.00 178.92 3hk9 h ALA 108 N 1.95 1.90 0.00 -0.75 0.00 -2.01 -2.24 119.26 118.10 3hk9 h ALA 108 Ca -0.00 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 3hk9 h ALA 108 Cb 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3hk9 h ALA 108 CO 0.01 0.00 -0.64 1.79 0.00 0.00 0.00 179.25 180.41 3hk9 h THR 109 N 0.47 1.40 -1.60 0.00 1.35 -1.94 -3.47 112.91 109.11 3hk9 h THR 109 Ca 0.24 -2.24 -0.36 0.00 -0.55 0.00 0.00 66.41 63.49 3hk9 h THR 109 Cb 0.33 2.23 -0.09 0.00 -1.73 0.00 0.00 68.15 68.89 3hk9 h THR 109 CO -0.06 0.63 -0.39 0.54 -0.25 0.00 0.00 175.52 175.99 3hk9 n ARG 110 N -3.69 -1.33 -2.87 4.72 1.74 -0.84 -4.90 116.66 109.50 3hk9 n ARG 110 Ca -0.01 1.01 -0.44 0.00 -0.77 0.00 0.00 57.85 57.65 3hk9 n ARG 110 Cb 0.65 -5.38 -0.00 0.00 -1.02 0.00 0.00 32.46 26.72 3hk9 n ARG 110 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3hk9 s ASP 111 N -2.54 7.01 0.35 0.55 -1.08 -1.26 -4.83 116.67 114.87 3hk9 s ASP 111 Ca 0.00 -2.84 0.08 0.00 -0.52 0.00 0.00 52.55 49.27 3hk9 s ASP 111 Cb 0.00 -2.44 0.80 0.00 -1.46 0.00 0.00 42.92 39.82 3hk9 s ASP 111 CO 0.00 -0.85 1.88 0.25 0.52 0.00 0.00 175.17 176.97 3hk9 h LEU 112 N 10.35 0.67 -0.77 -1.34 5.85 -1.98 -1.12 115.31 126.98 3hk9 h LEU 112 Ca 0.34 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 59.02 3hk9 h LEU 112 Cb 0.88 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 3hk9 h LEU 112 CO 1.29 0.35 0.07 -0.61 -0.34 0.00 0.00 178.44 179.19 3hk9 h GLN 113 N 0.71 1.00 -0.18 1.25 5.75 -1.99 -0.37 115.11 121.28 3hk9 h GLN 113 Ca 0.44 -0.27 -0.12 0.00 -0.15 0.00 0.00 58.65 58.55 3hk9 h GLN 113 Cb 0.67 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.09 3hk9 h GLN 113 CO -0.20 0.94 -0.39 0.28 -2.65 0.00 0.00 178.83 176.82 3hk9 h VAL 114 N 0.94 1.30 -0.56 2.39 2.07 -1.65 -2.52 116.25 118.21 3hk9 h VAL 114 Ca 0.18 -1.51 -0.08 0.00 0.82 0.00 0.00 66.70 66.12 3hk9 h VAL 114 Cb 0.45 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 3hk9 h VAL 114 CO 0.02 0.46 0.03 1.88 0.02 0.00 0.00 177.57 179.98 3hk9 h TYR 115 N 0.34 1.05 -0.20 1.57 0.05 -0.72 -2.88 116.97 116.17 3hk9 h TYR 115 Ca 0.03 -0.17 -0.04 0.00 0.05 0.00 0.00 58.73 58.60 3hk9 h TYR 115 Cb 0.83 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 38.28 3hk9 h TYR 115 CO 0.02 0.94 -0.04 0.00 -1.05 0.00 0.00 178.16 178.03 3hk9 h ARG 116 N 0.86 0.31 -0.20 4.88 3.08 -0.82 -2.62 114.38 119.86 3hk9 h ARG 116 Ca 0.16 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 3hk9 h ARG 116 Cb 0.50 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 3hk9 h ARG 116 CO 0.02 0.37 -0.22 0.93 -1.07 0.00 0.00 179.97 180.00 3hk9 h GLU 117 N 0.30 0.36 -0.45 0.04 5.08 -1.23 -2.35 114.58 116.32 3hk9 h GLU 117 Ca 0.07 -0.12 0.06 0.00 -1.00 0.00 0.00 59.36 58.37 3hk9 h GLU 117 Cb 0.28 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 3hk9 h GLU 117 CO 0.01 0.57 0.15 -0.92 -1.00 0.00 0.00 179.01 177.82 3hk9 h TYR 118 N 0.32 0.27 -0.01 4.33 3.20 -1.42 -2.81 116.97 120.85 3hk9 h TYR 118 Ca 0.05 0.02 -0.19 0.00 3.14 0.00 0.00 58.73 61.76 3hk9 h TYR 118 Cb 0.58 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 3hk9 h TYR 118 CO 0.01 0.09 -0.82 0.74 -1.64 0.00 0.00 178.16 176.54 3hk9 h PHE 119 N 0.32 0.27 -0.68 -3.82 0.04 -1.58 -3.32 116.94 108.17 3hk9 h PHE 119 Ca 0.21 -0.14 0.00 0.00 2.80 0.00 0.00 57.97 60.85 3hk9 h PHE 119 Cb 0.22 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 3hk9 h PHE 119 CO -0.16 0.93 0.45 0.00 -0.60 0.00 0.00 178.31 178.92 3hk9 h ALA 120 N 1.03 0.87 -0.65 2.45 0.00 -1.17 -3.06 119.26 118.73 3hk9 h ALA 120 Ca -0.03 -0.05 -0.63 0.00 0.00 0.00 0.00 54.91 54.19 3hk9 h ALA 120 Cb 1.43 -0.28 -0.17 0.00 0.00 0.00 0.00 17.79 18.77 3hk9 h ALA 120 CO 0.12 0.30 1.26 0.36 0.00 0.00 0.00 179.25 181.30 3hk9 n LYS 121 N -4.60 3.48 -3.53 0.00 2.85 -1.14 -4.87 118.16 110.35 3hk9 n LYS 121 Ca 0.06 -3.00 -0.15 0.00 -1.05 0.00 0.00 58.31 54.17 3hk9 n LYS 121 Cb 0.02 -2.36 -0.05 0.00 -0.65 0.00 0.00 35.03 31.99 3hk9 n LYS 121 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 3hk9 s LYS 122 N -1.80 0.91 0.31 -1.58 2.20 -1.16 -5.05 119.74 113.58 3hk9 s LYS 122 Ca 0.55 0.17 0.06 0.00 -0.36 0.00 0.00 55.97 56.40 3hk9 s LYS 122 Cb 0.30 0.43 -0.02 0.00 -1.51 0.00 0.00 37.83 37.03 3hk9 s LYS 122 CO -0.18 -0.29 0.41 0.95 -0.36 0.00 0.00 175.35 175.88 3hk9 s THR 123 N -1.34 4.23 0.18 3.43 -4.23 -1.26 -4.99 115.64 111.67 3hk9 s THR 123 Ca -0.07 -1.07 -0.13 0.00 -1.18 0.00 0.00 61.69 59.24 3hk9 s THR 123 Cb -0.00 -3.46 0.09 0.00 1.34 0.00 0.00 72.50 70.47 3hk9 s THR 123 CO 0.06 -0.20 1.82 0.28 -0.54 0.00 0.00 174.62 176.04 3hk9 h SER 124 N 1.03 0.55 -0.81 3.99 0.02 -1.98 -0.97 113.55 115.38 3hk9 h SER 124 Ca -0.47 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.48 3hk9 h SER 124 Cb 1.25 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.64 3hk9 h SER 124 CO 0.56 0.39 0.47 -0.33 -1.14 0.00 0.00 176.83 176.77 3hk9 h GLU 125 N 0.68 1.11 -0.39 3.45 3.07 -1.95 -1.62 114.58 118.92 3hk9 h GLU 125 Ca 0.23 -0.11 -0.08 0.00 -0.50 0.00 0.00 59.36 58.89 3hk9 h GLU 125 Cb 0.02 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 27.69 3hk9 h GLU 125 CO -0.10 0.79 -0.08 0.93 -1.40 0.00 0.00 179.01 179.15 3hk9 h GLU 126 N 1.11 0.74 -0.74 2.33 5.08 -1.85 -2.66 114.58 118.59 3hk9 h GLU 126 Ca 0.29 -0.28 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 3hk9 h GLU 126 Cb -0.01 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 3hk9 h GLU 126 CO -0.05 0.88 0.24 0.37 -1.00 0.00 0.00 179.01 179.44 3hk9 h GLN 127 N 0.55 1.14 -0.79 2.33 5.75 -0.95 -0.16 115.11 122.98 3hk9 h GLN 127 Ca 0.10 -0.24 -0.05 0.00 -0.15 0.00 0.00 58.65 58.31 3hk9 h GLN 127 Cb 0.60 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.94 3hk9 h GLN 127 CO 0.04 0.97 0.30 -0.39 -2.65 0.00 0.00 178.83 177.09 3hk9 h VAL 128 N 1.10 1.26 -0.31 2.39 -1.51 -1.24 0.15 116.25 118.09 3hk9 h VAL 128 Ca 0.24 -0.85 -0.00 0.00 -1.23 0.00 0.00 66.70 64.86 3hk9 h VAL 128 Cb 0.30 0.34 -0.01 0.00 -2.13 0.00 0.00 31.29 29.78 3hk9 h VAL 128 CO -0.01 0.34 0.18 0.44 -1.23 0.00 0.00 177.57 177.29 3hk9 h ASP 129 N 1.15 0.38 0.65 4.19 3.32 -1.06 -0.12 116.42 124.92 3hk9 h ASP 129 Ca 0.26 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 3hk9 h ASP 129 Cb 0.24 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 39.70 3hk9 h ASP 129 CO -0.02 0.35 -0.31 0.74 -1.72 0.00 0.00 179.24 178.28 3hk9 h THR 130 N 0.39 0.35 -0.36 0.35 2.02 -0.63 -2.62 112.91 112.40 3hk9 h THR 130 Ca 0.11 -0.08 0.03 0.00 0.77 0.00 0.00 66.41 67.24 3hk9 h THR 130 Cb 0.04 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 66.80 3hk9 h THR 130 CO -0.02 0.01 0.17 0.58 0.37 0.00 0.00 175.52 176.63 3hk9 h VAL 131 N -0.92 0.97 -0.83 3.16 2.07 -0.65 -0.18 116.25 119.86 3hk9 h VAL 131 Ca -0.09 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.34 3hk9 h VAL 131 Cb 0.68 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 3hk9 h VAL 131 CO 0.15 0.06 0.55 -0.07 0.02 0.00 0.00 177.57 178.28 3hk9 h LEU 132 N 0.36 0.91 -0.10 2.57 3.38 -1.06 0.99 115.31 122.36 3hk9 h LEU 132 Ca 0.16 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3hk9 h LEU 132 Cb 0.08 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 3hk9 h LEU 132 CO -0.12 0.63 -0.04 -0.61 0.09 0.00 0.00 178.44 178.39 3hk9 h GLN 133 N 1.06 0.20 -0.67 1.13 4.15 -1.03 -0.66 115.11 119.29 3hk9 h GLN 133 Ca 0.33 -0.09 -0.03 0.00 0.77 0.00 0.00 58.65 59.63 3hk9 h GLN 133 Cb -0.01 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.65 3hk9 h GLN 133 CO -0.09 0.55 0.30 -0.07 -1.93 0.00 0.00 178.83 177.59 3hk9 h LEU 134 N -0.16 0.90 -0.90 -2.39 3.38 -0.60 -2.52 115.31 113.02 3hk9 h LEU 134 Ca 0.02 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3hk9 h LEU 134 Cb 0.49 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3hk9 h LEU 134 CO 0.01 0.80 0.00 0.00 0.09 0.00 0.00 178.44 179.34 3hk9 n ALA 135 N -2.37 2.56 -4.06 1.53 0.00 0.30 -4.93 120.51 113.53 3hk9 n ALA 135 Ca 0.05 -0.44 -0.29 0.00 0.00 0.00 0.00 53.44 52.76 3hk9 n ALA 135 Cb 0.15 -1.16 -0.03 0.00 0.00 0.00 0.00 19.45 18.41 3hk9 n ALA 135 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3hk9 n ASN 136 N 0.10 -0.96 -4.54 0.00 5.15 -0.38 -4.81 115.26 109.83 3hk9 n ASN 136 Ca 0.18 -1.04 -0.36 0.00 -0.60 0.00 0.00 54.58 52.76 3hk9 n ASN 136 Cb 0.31 -2.83 -0.11 0.00 -0.53 0.00 0.00 39.78 36.62 3hk9 n ASN 136 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hk9 s VAL 137 N -3.83 4.65 -0.15 3.44 1.01 -0.48 -0.78 120.40 124.26 3hk9 s VAL 137 Ca 0.19 -0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.20 3hk9 s VAL 137 Cb -0.11 -3.15 -0.23 0.00 0.00 0.00 0.00 36.38 32.89 3hk9 s VAL 137 CO 0.91 0.37 0.26 -1.54 0.00 0.00 0.00 175.10 175.11 3hk9 n SER 138 N 4.37 1.01 -3.90 3.32 3.41 0.34 -4.71 113.62 117.46 3hk9 n SER 138 Ca -0.16 0.15 -0.18 0.00 -0.26 0.00 0.00 58.87 58.42 3hk9 n SER 138 Cb 0.52 0.08 -0.16 0.00 -0.26 0.00 0.00 64.21 64.39 3hk9 n SER 138 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3hk9 s ASP 139 N -6.14 0.66 -0.11 4.04 1.01 -1.04 -4.70 116.67 110.39 3hk9 s ASP 139 Ca -0.15 -0.09 0.03 0.00 0.71 0.00 0.00 52.55 53.06 3hk9 s ASP 139 Cb 0.07 -0.25 -0.00 0.00 1.01 0.00 0.00 42.92 43.76 3hk9 s ASP 139 CO 0.78 -0.02 -0.22 -0.69 0.21 0.00 0.00 175.17 175.22 3hk9 s VAL 140 N 0.56 2.22 -0.23 -1.27 1.01 0.17 -0.42 120.40 122.44 3hk9 s VAL 140 Ca -0.06 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 60.86 3hk9 s VAL 140 Cb -0.10 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.37 3hk9 s VAL 140 CO -0.00 0.55 0.15 -0.69 0.00 0.00 0.00 175.10 175.11 3hk9 s VAL 141 N 0.39 5.29 0.78 2.92 1.01 -0.33 0.09 120.40 130.55 3hk9 s VAL 141 Ca -0.17 0.15 -0.05 0.00 0.00 0.00 0.00 61.98 61.92 3hk9 s VAL 141 Cb -0.17 -3.46 0.14 0.00 0.00 0.00 0.00 36.38 32.89 3hk9 s VAL 141 CO 0.07 0.36 1.08 -0.04 0.00 0.00 0.00 175.10 176.58 3hk9 s MET 142 N 0.96 1.46 -0.40 2.72 -1.94 0.78 -1.94 119.30 120.94 3hk9 s MET 142 Ca 0.07 -0.85 0.03 0.00 -1.71 0.00 0.00 55.69 53.23 3hk9 s MET 142 Cb -0.13 -2.19 0.11 0.00 2.01 0.00 0.00 34.83 34.63 3hk9 s MET 142 CO 0.03 -1.68 0.13 0.99 -0.01 0.00 0.00 175.02 174.49 3hk9 s THR 143 N -3.34 2.53 -0.43 2.05 2.01 -1.18 -3.57 115.64 113.70 3hk9 s THR 143 Ca 0.68 -2.53 -0.16 0.00 0.31 0.00 0.00 61.69 59.99 3hk9 s THR 143 Cb -0.05 -2.81 0.03 0.00 0.01 0.00 0.00 72.50 69.67 3hk9 s THR 143 CO 0.47 -0.66 0.36 0.20 -0.69 0.00 0.00 174.62 174.30 3hk9 s ASN 144 N 0.78 6.14 -0.37 3.53 -0.87 0.78 -4.91 114.94 120.02 3hk9 s ASN 144 Ca 0.12 -0.95 -0.12 0.00 -1.57 0.00 0.00 52.86 50.35 3hk9 s ASN 144 Cb -0.21 -2.18 0.02 0.00 -0.02 0.00 0.00 41.25 38.85 3hk9 s ASN 144 CO -0.06 -0.54 0.22 -0.62 -2.57 0.00 0.00 177.10 173.53 3hk9 s ASP 145 N 1.95 5.80 0.27 -1.22 2.15 -1.26 -0.67 116.67 123.69 3hk9 s ASP 145 Ca 0.07 -0.88 0.25 0.00 0.43 0.00 0.00 52.55 52.42 3hk9 s ASP 145 Cb -0.20 -2.05 0.96 0.00 -0.30 0.00 0.00 42.92 41.33 3hk9 s ASP 145 CO 0.10 -0.36 1.74 1.55 -0.17 0.00 0.00 175.17 178.03 3hk9 h PRO 146 N 8.47 0.00 -0.00 4.34 0.13 -1.96 -2.75 132.00 140.22 3hk9 h PRO 146 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3hk9 h PRO 146 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3hk9 h PRO 146 CO 0.67 0.00 -0.11 1.19 -0.23 0.00 0.00 178.00 179.52 3hk9 n PHE 147 N -2.31 0.00 -3.17 1.56 3.72 -1.26 -4.65 117.46 111.36 3hk9 n PHE 147 Ca 0.03 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.99 3hk9 n PHE 147 Cb 0.28 -0.21 -0.06 0.00 -0.94 0.00 0.00 39.48 38.55 3hk9 n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3hk9 s ASP 148 N -2.53 6.21 0.25 4.37 3.68 -1.04 -4.97 116.67 122.64 3hk9 s ASP 148 Ca 0.27 -1.07 -0.13 0.00 2.13 0.00 0.00 52.55 53.76 3hk9 s ASP 148 Cb 0.20 -2.28 0.33 0.00 -1.45 0.00 0.00 42.92 39.71 3hk9 s ASP 148 CO 0.49 -0.91 1.51 0.47 0.13 0.00 0.00 175.17 176.86 3hk9 n ASP 149 N 6.09 -0.51 0.22 -0.34 8.00 -1.26 -0.49 116.55 128.26 3hk9 n ASP 149 Ca -0.08 1.69 -0.15 0.00 0.71 0.00 0.00 54.79 56.96 3hk9 n ASP 149 Cb 0.45 -0.44 -0.09 0.00 -0.02 0.00 0.00 41.12 41.02 3hk9 n ASP 149 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 3hk9 h ASN 150 N 0.00 -1.24 -0.28 -2.24 2.35 -1.95 -1.49 115.58 110.73 3hk9 h ASN 150 Ca 0.39 0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 56.23 3hk9 h ASN 150 Cb 0.64 0.42 -0.02 0.00 0.05 0.00 0.00 38.32 39.41 3hk9 h ASN 150 CO -0.98 -0.56 0.11 -0.08 -1.65 0.00 0.00 177.43 174.28 3hk9 h GLU 151 N -0.82 0.49 -0.44 0.81 4.81 -1.73 -2.72 114.58 114.98 3hk9 h GLU 151 Ca -0.04 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 3hk9 h GLU 151 Cb 0.73 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 3hk9 h GLU 151 CO -0.10 0.43 0.25 -0.09 -0.73 0.00 0.00 179.01 178.77 3hk9 h ARG 152 N 0.49 0.60 -0.80 1.92 2.43 -0.43 -2.54 114.38 116.04 3hk9 h ARG 152 Ca 0.12 -0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.30 3hk9 h ARG 152 Cb 0.14 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 3hk9 h ARG 152 CO -0.01 0.45 0.52 0.82 -1.51 0.00 0.00 179.97 180.25 3hk9 h ILE 153 N 0.57 1.01 -0.63 1.20 2.04 -0.95 -0.42 117.51 120.34 3hk9 h ILE 153 Ca 0.16 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.75 3hk9 h ILE 153 Cb 0.02 0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.17 3hk9 h ILE 153 CO -0.03 0.15 0.40 0.28 0.00 0.00 0.00 178.15 178.95 3hk9 h SER 154 N 0.83 0.66 -0.29 1.72 0.02 -1.45 0.10 113.55 115.15 3hk9 h SER 154 Ca 0.35 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 61.17 3hk9 h SER 154 Cb 0.29 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 3hk9 h SER 154 CO -0.13 0.47 -0.32 -0.50 -1.14 0.00 0.00 176.83 175.21 3hk9 h TRP 155 N 0.79 0.88 -0.26 3.45 4.06 -1.20 -2.47 115.95 121.20 3hk9 h TRP 155 Ca 0.24 -0.27 -0.01 0.00 2.06 0.00 0.00 58.89 60.92 3hk9 h TRP 155 Cb -0.03 -0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 27.94 3hk9 h TRP 155 CO -0.04 1.03 0.14 -0.07 -3.56 0.00 0.00 178.44 175.94 3hk9 h LEU 156 N 0.48 0.31 -0.97 -4.49 3.38 -0.73 -1.08 115.31 112.21 3hk9 h LEU 156 Ca 0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3hk9 h LEU 156 Cb 0.90 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.57 3hk9 h LEU 156 CO 0.08 0.26 0.00 -0.33 0.09 0.00 0.00 178.44 178.54 3hk9 h GLU 157 N 0.36 0.00 0.00 1.13 5.08 -0.65 -3.46 114.58 117.04 3hk9 h GLU 157 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3hk9 h GLU 157 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3hk9 h GLU 157 CO -0.02 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.40 3hk9 n GLY 158 N 0.05 0.77 3.76 -3.84 0.00 -0.41 -5.07 105.19 100.45 3hk9 n GLY 158 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 3hk9 n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hk9 s LYS 159 N -0.98 3.28 -0.01 1.61 1.02 -0.94 -5.03 119.74 118.68 3hk9 s LYS 159 Ca 0.00 2.07 0.03 0.00 0.02 0.00 0.00 55.97 58.09 3hk9 s LYS 159 Cb 0.00 -2.27 -0.01 0.00 -0.52 0.00 0.00 37.83 35.04 3hk9 s LYS 159 CO 0.00 -1.02 -0.10 -0.65 -0.92 0.00 0.00 175.35 172.66 3hk9 s GLN 160 N -2.89 0.80 0.51 1.68 -1.52 -1.26 -4.69 119.66 112.29 3hk9 s GLN 160 Ca 0.70 -0.35 -0.19 0.00 -1.95 0.00 0.00 55.36 53.57 3hk9 s GLN 160 Cb -0.36 -0.78 -0.07 0.00 -0.22 0.00 0.00 33.01 31.58 3hk9 s GLN 160 CO 0.43 0.21 1.04 -1.25 -0.25 0.00 0.00 175.29 175.47 3hk9 s PRO 161 N -0.22 3.70 1.08 2.91 0.04 -1.26 -4.94 135.00 136.31 3hk9 s PRO 161 Ca 0.04 1.33 -0.14 0.00 0.04 0.00 0.00 61.00 62.27 3hk9 s PRO 161 Cb -0.04 -2.08 0.23 0.00 0.04 0.00 0.00 34.50 32.65 3hk9 s PRO 161 CO -0.00 -0.52 1.07 0.16 0.04 0.00 0.00 177.00 177.75 3hk9 s ASP 162 N -2.15 1.85 0.66 6.66 1.47 -1.26 -4.83 116.67 119.06 3hk9 s ASP 162 Ca 0.67 1.17 0.29 0.00 1.18 0.00 0.00 52.55 55.86 3hk9 s ASP 162 Cb -0.16 -1.82 1.59 0.00 -0.34 0.00 0.00 42.92 42.19 3hk9 s ASP 162 CO 0.24 -3.61 1.89 0.77 0.68 0.00 0.00 175.17 175.13 3hk9 h SER 163 N -2.22 0.00 1.51 2.11 4.64 -2.00 -1.33 113.55 116.26 3hk9 h SER 163 Ca -0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 3hk9 h SER 163 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 3hk9 h SER 163 CO 0.53 0.00 -0.28 0.03 -0.87 0.00 0.00 176.83 176.24 3hk9 h ARG 164 N 0.00 0.00 -5.75 4.77 3.08 -1.89 -3.46 114.38 111.14 3hk9 h ARG 164 Ca 0.00 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.39 3hk9 h ARG 164 Cb 0.68 0.00 -0.20 0.00 0.08 0.00 0.00 29.97 30.52 3hk9 h ARG 164 CO 0.00 0.00 -0.68 -0.06 -1.07 0.00 0.00 179.97 178.16 3hk9 s PHE 165 N -3.21 2.98 0.11 3.04 0.08 -0.50 -0.66 117.98 119.83 3hk9 s PHE 165 Ca 0.06 -0.14 0.10 0.00 0.12 0.00 0.00 56.93 57.08 3hk9 s PHE 165 Cb 0.09 -1.82 -0.04 0.00 -0.57 0.00 0.00 43.02 40.68 3hk9 s PHE 165 CO 0.68 0.16 -0.26 -1.01 -0.10 0.00 0.00 175.22 174.70 3hk9 s HIS 166 N -0.28 2.22 0.29 0.36 3.76 0.11 -4.65 115.29 117.09 3hk9 s HIS 166 Ca 0.04 -0.39 -0.03 0.00 -0.15 0.00 0.00 55.06 54.53 3hk9 s HIS 166 Cb -0.13 -1.22 -0.05 0.00 1.11 0.00 0.00 32.58 32.30 3hk9 s HIS 166 CO 0.02 0.29 0.52 0.00 -0.85 0.00 0.00 174.74 174.73 3hk9 s ALA 167 N -1.04 3.68 -0.11 -1.40 0.00 -1.26 -0.16 121.76 121.46 3hk9 s ALA 167 Ca 0.12 -0.68 -0.04 0.00 0.00 0.00 0.00 51.96 51.37 3hk9 s ALA 167 Cb -0.10 -2.21 0.06 0.00 0.00 0.00 0.00 23.12 20.87 3hk9 s ALA 167 CO 0.05 0.22 0.15 0.00 0.00 0.00 0.00 175.76 176.18 3hk9 s ALA 168 N -2.10 -0.03 -0.60 0.00 0.00 -1.23 -0.72 121.76 117.08 3hk9 s ALA 168 Ca 0.42 0.31 -0.27 0.00 0.00 0.00 0.00 51.96 52.42 3hk9 s ALA 168 Cb -0.11 -0.92 0.01 0.00 0.00 0.00 0.00 23.12 22.10 3hk9 s ALA 168 CO 0.31 -0.78 1.52 -1.17 0.00 0.00 0.00 175.76 175.65 3hk9 s LEU 169 N 2.26 3.33 -0.07 0.00 2.96 -0.88 -0.15 118.68 126.12 3hk9 s LEU 169 Ca 0.04 0.20 -0.24 0.00 -0.22 0.00 0.00 54.13 53.90 3hk9 s LEU 169 Cb -0.13 -2.84 -0.03 0.00 0.50 0.00 0.00 46.19 43.69 3hk9 s LEU 169 CO -0.07 -1.91 0.75 -0.60 -1.32 0.00 0.00 176.35 173.20 3hk9 s ARG 170 N 5.97 4.43 -0.16 1.98 6.06 0.16 -1.26 118.95 136.13 3hk9 s ARG 170 Ca 0.54 0.97 0.15 0.00 -2.50 0.00 0.00 55.73 54.89 3hk9 s ARG 170 Cb -0.11 -3.47 0.34 0.00 0.06 0.00 0.00 34.95 31.77 3hk9 s ARG 170 CO 0.22 -0.00 1.17 1.28 -2.50 0.00 0.00 175.30 175.47 3hk9 n LEU 171 N 3.98 2.40 -0.18 -0.88 4.77 -0.18 -4.42 117.00 122.49 3hk9 n LEU 171 Ca 0.00 -3.34 -0.04 0.00 -0.03 0.00 0.00 56.01 52.61 3hk9 n LEU 171 Cb 0.51 -0.45 0.02 0.00 -2.33 0.00 0.00 43.42 41.17 3hk9 n LEU 171 CO 0.48 0.97 0.68 0.44 -1.33 0.00 0.00 177.39 178.63 3hk9 h ASP 172 N 0.42 -0.90 -0.63 -1.43 5.19 -1.94 -1.00 116.42 116.13 3hk9 h ASP 172 Ca -0.00 0.20 0.07 0.00 -0.62 0.00 0.00 57.03 56.68 3hk9 h ASP 172 Cb 1.03 0.48 -0.06 0.00 0.18 0.00 0.00 39.33 40.96 3hk9 h ASP 172 CO 0.00 -0.27 0.31 -0.65 -3.12 0.00 0.00 179.24 175.51 3hk9 h PRO 173 N -0.12 0.55 0.21 3.56 0.11 -1.94 0.39 132.00 134.76 3hk9 h PRO 173 Ca 0.24 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.31 3hk9 h PRO 173 Cb 0.51 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.50 3hk9 h PRO 173 CO -0.63 0.37 -0.10 1.25 -0.21 0.00 0.00 178.00 178.68 3hk9 h LEU 174 N 0.57 -0.24 -0.37 2.35 5.85 -1.69 0.35 115.31 122.14 3hk9 h LEU 174 Ca 0.29 -0.18 -0.19 0.00 0.84 0.00 0.00 57.88 58.64 3hk9 h LEU 174 Cb 0.25 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 3hk9 h LEU 174 CO -0.22 0.06 -0.81 -0.07 -0.34 0.00 0.00 178.44 177.06 3hk9 h LEU 175 N -0.54 0.31 0.00 2.25 4.07 -1.10 -3.19 115.31 117.12 3hk9 h LEU 175 Ca -0.03 -0.23 -0.15 0.00 0.08 0.00 0.00 57.88 57.55 3hk9 h LEU 175 Cb 0.40 -0.09 -0.03 0.00 1.08 0.00 0.00 40.66 42.02 3hk9 h LEU 175 CO 0.05 0.99 -2.05 0.59 -1.08 0.00 0.00 178.44 176.94 3hk9 n ASN 176 N -3.74 0.51 -2.45 -0.43 3.02 0.14 -3.85 115.26 108.46 3hk9 n ASN 176 Ca -0.04 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.33 3hk9 n ASN 176 Cb 0.76 1.48 0.02 0.00 -0.61 0.00 0.00 39.78 41.43 3hk9 n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hk9 n GLU 177 N -2.40 2.75 -0.25 3.52 1.02 0.10 -4.91 120.64 120.48 3hk9 n GLU 177 Ca -0.15 -4.01 0.02 0.00 -0.02 0.00 0.00 57.16 53.00 3hk9 n GLU 177 Cb 0.77 -1.95 0.14 0.00 -0.02 0.00 0.00 31.44 30.38 3hk9 n GLU 177 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 3hk9 h TYR 178 N 2.56 0.68 -0.52 -0.32 3.20 -1.52 0.27 116.97 121.33 3hk9 h TYR 178 Ca 0.17 0.03 0.10 0.00 3.14 0.00 0.00 58.73 62.17 3hk9 h TYR 178 Cb 1.19 -0.20 -0.09 0.00 1.54 0.00 0.00 36.73 39.18 3hk9 h TYR 178 CO 0.71 0.26 -0.02 0.93 -1.64 0.00 0.00 178.16 178.40 3hk9 h GLU 179 N 0.64 0.09 0.00 1.82 4.39 -1.90 0.40 114.58 120.02 3hk9 h GLU 179 Ca 0.36 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.05 3hk9 h GLU 179 Cb 0.36 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.99 3hk9 h GLU 179 CO -0.26 0.06 -0.45 1.96 -1.16 0.00 0.00 179.01 179.16 3hk9 h GLN 180 N 0.09 0.00 0.06 2.33 7.50 -1.85 -3.35 115.11 119.89 3hk9 h GLN 180 Ca 0.26 0.00 -0.27 0.00 0.50 0.00 0.00 58.65 59.14 3hk9 h GLN 180 Cb 0.41 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.92 3hk9 h GLN 180 CO -0.46 0.02 -1.39 1.15 -1.50 0.00 0.00 178.83 176.65 3hk9 h THR 181 N 0.00 1.28 -0.27 -0.54 2.02 0.11 -3.34 112.91 112.17 3hk9 h THR 181 Ca -0.00 -2.98 0.08 0.00 0.77 0.00 0.00 66.41 64.27 3hk9 h THR 181 Cb 1.02 2.73 -0.01 0.00 -1.74 0.00 0.00 68.15 70.15 3hk9 h THR 181 CO 0.00 0.80 0.29 0.07 0.37 0.00 0.00 175.52 177.05 3hk9 h LYS 182 N 0.03 0.00 0.00 6.66 2.10 -0.38 0.12 116.57 125.10 3hk9 h LYS 182 Ca -0.18 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.36 3hk9 h LYS 182 Cb 1.94 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 33.25 3hk9 h LYS 182 CO 0.14 0.00 -0.55 0.45 -2.00 0.00 0.00 179.45 177.49 3hk9 h HIS 183 N 0.00 0.00 0.00 0.07 3.86 -1.78 -2.99 115.15 114.32 3hk9 h HIS 183 Ca 0.13 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.12 3hk9 h HIS 183 Cb 0.70 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.14 3hk9 h HIS 183 CO 0.00 0.55 -1.04 0.00 0.86 0.00 0.00 177.93 178.30 3hk9 h ARG 184 N 0.00 0.00 0.01 2.45 3.08 -0.97 -3.04 114.38 115.91 3hk9 h ARG 184 Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3hk9 h ARG 184 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 3hk9 h ARG 184 CO 0.07 0.92 -0.00 -0.07 -1.07 0.00 0.00 179.97 179.81 3hk9 h LEU 185 N 0.00 -0.01 -1.78 3.04 3.38 -1.32 -2.40 115.31 116.23 3hk9 h LEU 185 Ca -0.04 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3hk9 h LEU 185 Cb 1.77 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.52 3hk9 h LEU 185 CO 0.12 0.10 -0.11 0.08 0.09 0.00 0.00 178.44 178.72 3hk9 h ARG 186 N -0.12 0.00 -0.13 1.13 0.11 -1.35 0.50 114.38 114.51 3hk9 h ARG 186 Ca -0.00 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.05 3hk9 h ARG 186 Cb 0.11 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.18 3hk9 h ARG 186 CO 0.00 0.11 -0.07 -0.44 0.10 0.00 0.00 179.97 179.68 3hk9 h ASP 187 N 0.00 0.18 -0.21 0.08 3.32 -1.32 -1.51 116.42 116.96 3hk9 h ASP 187 Ca -0.00 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3hk9 h ASP 187 Cb 0.20 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3hk9 h ASP 187 CO 0.01 0.28 0.00 0.79 -1.72 0.00 0.00 179.24 178.61 3hk9 n TRP 188 N -4.35 0.26 -0.03 4.55 8.01 0.03 -4.90 117.44 121.01 3hk9 n TRP 188 Ca -0.01 -0.13 0.00 0.00 -1.31 0.00 0.00 57.50 56.05 3hk9 n TRP 188 Cb 0.21 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.51 3hk9 n TRP 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3hk9 n GLY 189 N 1.18 0.98 3.30 6.99 0.00 -0.57 -5.05 105.19 112.01 3hk9 n GLY 189 Ca 0.16 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.73 3hk9 n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hk9 s TYR 190 N -2.00 3.30 -0.89 1.61 2.02 -0.42 -4.95 117.35 116.02 3hk9 s TYR 190 Ca 0.00 -1.38 -0.22 0.00 -0.37 0.00 0.00 57.07 55.10 3hk9 s TYR 190 Cb 0.00 -3.53 -0.13 0.00 -0.40 0.00 0.00 41.96 37.89 3hk9 s TYR 190 CO 0.00 -0.96 1.93 1.63 -1.57 0.00 0.00 175.55 176.59 3hk9 n LYS 191 N 5.13 1.61 -3.30 -0.62 5.02 -1.26 -2.59 118.16 122.15 3hk9 n LYS 191 Ca -0.12 -2.03 -0.38 0.00 -2.02 0.00 0.00 58.31 53.75 3hk9 n LYS 191 Cb 0.41 -3.11 -0.06 0.00 -0.02 0.00 0.00 35.03 32.25 3hk9 n LYS 191 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3hk9 s VAL 192 N 6.13 4.85 0.53 -0.18 -7.23 -1.26 -4.42 120.40 118.82 3hk9 s VAL 192 Ca 0.59 1.14 0.02 0.00 -1.81 0.00 0.00 61.98 61.92 3hk9 s VAL 192 Cb 0.11 -3.87 0.03 0.00 0.56 0.00 0.00 36.38 33.21 3hk9 s VAL 192 CO 0.11 0.52 0.75 0.20 -0.31 0.00 0.00 175.10 176.37 3hk9 s ASN 193 N -0.82 5.37 0.31 4.85 0.02 -1.26 -4.97 114.94 118.44 3hk9 s ASN 193 Ca 0.28 -0.01 -0.00 0.00 -1.02 0.00 0.00 52.86 52.11 3hk9 s ASN 193 Cb -0.18 -0.93 0.51 0.00 0.02 0.00 0.00 41.25 40.67 3hk9 s ASN 193 CO 0.17 -1.06 1.95 0.44 0.02 0.00 0.00 177.10 178.62 3hk9 h ASP 194 N 0.15 0.82 -3.04 -1.22 5.19 -2.02 -3.42 116.42 112.88 3hk9 h ASP 194 Ca -0.42 -0.05 -0.62 0.00 -0.62 0.00 0.00 57.03 55.32 3hk9 h ASP 194 Cb 1.29 -0.21 -0.08 0.00 0.18 0.00 0.00 39.33 40.51 3hk9 h ASP 194 CO 0.52 0.64 -0.58 -1.83 -3.12 0.00 0.00 179.24 174.87 3hk9 s GLU 195 N -5.67 2.93 -1.21 3.56 -1.05 -1.26 -5.03 118.70 110.98 3hk9 s GLU 195 Ca -0.11 -0.71 -0.20 0.00 -0.15 0.00 0.00 54.97 53.80 3hk9 s GLU 195 Cb 0.17 -2.73 0.04 0.00 -0.44 0.00 0.00 34.13 31.17 3hk9 s GLU 195 CO 0.78 0.55 1.72 -0.46 0.95 0.00 0.00 175.26 178.80 3hk9 s TRP 196 N -1.49 2.56 0.54 4.83 -0.11 -1.26 -4.68 118.94 119.34 3hk9 s TRP 196 Ca 0.30 -1.05 0.04 0.00 1.22 0.00 0.00 56.10 56.61 3hk9 s TRP 196 Cb -0.12 -4.60 0.03 0.00 -1.50 0.00 0.00 33.47 27.28 3hk9 s TRP 196 CO 0.23 -1.75 0.33 0.54 -4.62 0.00 0.00 176.95 171.69 3hk9 s ASN 197 N 4.90 4.53 0.51 5.86 2.20 -1.26 -4.95 114.94 126.73 3hk9 s ASN 197 Ca 0.55 -1.34 0.28 0.00 -0.94 0.00 0.00 52.86 51.41 3hk9 s ASN 197 Cb 0.02 0.49 1.38 0.00 -2.00 0.00 0.00 41.25 41.14 3hk9 s ASN 197 CO 0.05 -1.08 1.88 -0.08 -2.94 0.00 0.00 177.10 174.92 3hk9 h GLU 198 N 0.84 0.10 -0.07 3.55 4.57 -1.99 -1.31 114.58 120.26 3hk9 h GLU 198 Ca -0.38 -0.01 -0.16 0.00 -1.18 0.00 0.00 59.36 57.63 3hk9 h GLU 198 Cb 1.31 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 29.89 3hk9 h GLU 198 CO 0.60 0.07 -0.60 0.78 -1.18 0.00 0.00 179.01 178.68 3hk9 h GLY 199 N 0.10 0.59 0.92 1.92 0.00 -1.93 -2.18 103.07 102.49 3hk9 h GLY 199 Ca 0.44 -0.90 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 3hk9 h GLY 199 CO -0.06 0.80 0.08 1.76 0.00 0.00 0.00 176.54 179.12 3hk9 h SER 200 N 0.13 0.56 -0.84 0.19 0.02 -1.48 -1.67 113.55 110.46 3hk9 h SER 200 Ca -0.05 -0.24 0.02 0.00 -0.84 0.00 0.00 61.79 60.68 3hk9 h SER 200 Cb 1.26 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 63.60 3hk9 h SER 200 CO 0.12 0.66 0.55 0.40 -1.14 0.00 0.00 176.83 177.42 3hk9 h ILE 201 N 0.44 1.17 -0.50 3.27 2.04 -1.40 -1.03 117.51 121.50 3hk9 h ILE 201 Ca 0.11 -0.37 -0.12 0.00 1.00 0.00 0.00 64.86 65.48 3hk9 h ILE 201 Cb 0.32 -0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 3hk9 h ILE 201 CO 0.00 0.20 -0.18 -0.61 0.00 0.00 0.00 178.15 177.57 3hk9 h GLN 202 N 1.09 0.98 -0.09 2.37 5.75 -1.16 -2.15 115.11 121.90 3hk9 h GLN 202 Ca 0.32 -0.39 -0.17 0.00 -0.15 0.00 0.00 58.65 58.26 3hk9 h GLN 202 Cb -0.05 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 3hk9 h GLN 202 CO -0.09 1.07 -0.68 0.93 -2.65 0.00 0.00 178.83 177.40 3hk9 h GLU 203 N 0.86 0.38 -0.00 1.69 4.39 -1.01 -1.29 114.58 119.59 3hk9 h GLU 203 Ca 0.12 -0.29 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 3hk9 h GLU 203 Cb 0.74 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.45 3hk9 h GLU 203 CO 0.06 0.92 0.00 0.28 -1.16 0.00 0.00 179.01 179.11 3hk9 h VAL 204 N 0.27 1.14 -0.76 3.13 2.07 -1.12 0.23 116.25 121.21 3hk9 h VAL 204 Ca -0.02 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.12 3hk9 h VAL 204 Cb 1.24 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.38 3hk9 h VAL 204 CO 0.12 0.11 0.50 0.11 0.02 0.00 0.00 177.57 178.42 3hk9 h LYS 205 N -0.17 0.92 -0.69 1.57 1.57 -1.35 -0.66 116.57 117.76 3hk9 h LYS 205 Ca 0.00 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 3hk9 h LYS 205 Cb 0.18 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 3hk9 h LYS 205 CO -0.00 0.61 0.31 -0.09 -0.57 0.00 0.00 179.45 179.71 3hk9 h ARG 206 N 0.95 1.01 0.35 3.15 2.43 -0.78 0.17 114.38 121.66 3hk9 h ARG 206 Ca 0.30 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 3hk9 h ARG 206 Cb 0.01 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.39 3hk9 h ARG 206 CO -0.08 0.82 -0.19 0.35 -1.51 0.00 0.00 179.97 179.35 3hk9 h PHE 207 N 0.97 -0.50 -0.59 2.20 3.57 0.36 0.14 116.94 123.09 3hk9 h PHE 207 Ca 0.23 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.79 3hk9 h PHE 207 Cb 0.16 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 3hk9 h PHE 207 CO 0.01 -0.31 0.30 -0.07 -2.23 0.00 0.00 178.31 176.01 3hk9 h LEU 208 N -0.51 0.42 -0.52 0.59 3.38 -0.86 -2.10 115.31 115.71 3hk9 h LEU 208 Ca -0.04 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3hk9 h LEU 208 Cb 0.41 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3hk9 h LEU 208 CO 0.06 0.28 0.24 0.74 0.09 0.00 0.00 178.44 179.84 3hk9 h THR 209 N 0.56 1.20 -0.30 0.22 2.02 -0.39 -0.98 112.91 115.24 3hk9 h THR 209 Ca 0.27 -0.59 0.00 0.00 0.77 0.00 0.00 66.41 66.86 3hk9 h THR 209 Cb 0.20 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 3hk9 h THR 209 CO -0.19 0.23 0.20 0.44 0.37 0.00 0.00 175.52 176.56 3hk9 h ASP 210 N 0.69 0.34 0.52 4.18 3.32 -0.29 -1.46 116.42 123.72 3hk9 h ASP 210 Ca 0.18 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.15 3hk9 h ASP 210 Cb 0.14 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3hk9 h ASP 210 CO -0.02 0.25 -0.32 -0.50 -1.72 0.00 0.00 179.24 176.93 3hk9 h TRP 211 N 0.40 0.00 -0.25 4.55 4.06 -1.25 -1.83 115.95 121.63 3hk9 h TRP 211 Ca 0.11 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 60.91 3hk9 h TRP 211 Cb -0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 3hk9 h TRP 211 CO -0.06 0.32 -0.44 0.82 -3.56 0.00 0.00 178.44 175.53 3hk9 h ILE 212 N 0.00 1.30 -0.09 1.49 2.04 -0.62 0.24 117.51 121.88 3hk9 h ILE 212 Ca -0.00 -1.62 -0.13 0.00 1.00 0.00 0.00 64.86 64.11 3hk9 h ILE 212 Cb 0.67 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 3hk9 h ILE 212 CO 0.04 0.51 -0.51 -0.33 0.00 0.00 0.00 178.15 177.87 3hk9 h GLU 213 N 0.50 0.23 0.13 2.37 5.08 -0.87 0.09 114.58 122.12 3hk9 h GLU 213 Ca 0.04 -0.13 -0.22 0.00 -1.00 0.00 0.00 59.36 58.05 3hk9 h GLU 213 Cb 0.96 0.01 0.02 0.00 0.50 0.00 0.00 28.75 30.25 3hk9 h GLU 213 CO 0.09 0.69 -0.92 -0.09 -1.00 0.00 0.00 179.01 177.77 3hk9 h ARG 214 N 0.18 0.39 0.00 2.33 2.43 -1.08 -3.38 114.38 115.25 3hk9 h ARG 214 Ca 0.01 -0.60 -0.25 0.00 -0.81 0.00 0.00 59.98 58.33 3hk9 h ARG 214 Cb 0.96 0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.68 3hk9 h ARG 214 CO 0.08 1.27 -1.73 -1.33 -1.51 0.00 0.00 179.97 176.74 3hk9 n MET 215 N -4.05 0.64 -3.64 0.20 2.81 0.05 -4.99 117.12 108.15 3hk9 n MET 215 Ca -0.14 0.20 -0.22 0.00 -1.81 0.00 0.00 57.70 55.73 3hk9 n MET 215 Cb 0.86 -1.74 0.04 0.00 -0.71 0.00 0.00 33.22 31.66 3hk9 n MET 215 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3hk9 n ASP 216 N -2.91 -2.62 -4.76 7.83 2.03 0.02 -4.57 116.55 111.57 3hk9 n ASP 216 Ca -0.17 -0.84 -0.38 0.00 0.52 0.00 0.00 54.79 53.93 3hk9 n ASP 216 Cb 0.98 -4.09 0.01 0.00 -0.72 0.00 0.00 41.12 37.30 3hk9 n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3hk9 s PRO 217 N -5.77 3.50 0.24 -0.67 0.04 -1.26 -4.60 135.00 126.48 3hk9 s PRO 217 Ca 0.15 1.97 0.26 0.00 0.04 0.00 0.00 61.00 63.41 3hk9 s PRO 217 Cb -0.04 -2.35 0.85 0.00 0.04 0.00 0.00 34.50 33.00 3hk9 s PRO 217 CO 0.81 -0.82 1.76 -0.39 0.04 0.00 0.00 177.00 178.40 3hk9 h VAL 218 N 1.70 0.00 -1.65 -0.36 -1.51 -1.28 -3.47 116.25 109.69 3hk9 h VAL 218 Ca -0.50 -0.44 0.27 0.00 -1.23 0.00 0.00 66.70 64.80 3hk9 h VAL 218 Cb 1.27 1.37 -0.14 0.00 -2.13 0.00 0.00 31.29 31.66 3hk9 h VAL 218 CO 0.59 0.00 0.75 -0.72 -1.23 0.00 0.00 177.57 176.96 3hk9 s TYR 219 N -3.18 -0.11 -0.09 5.19 -0.85 -1.26 -4.31 117.35 112.74 3hk9 s TYR 219 Ca 0.09 -0.01 -0.02 0.00 -0.52 0.00 0.00 57.07 56.61 3hk9 s TYR 219 Cb 0.11 0.55 -0.03 0.00 0.38 0.00 0.00 41.96 42.97 3hk9 s TYR 219 CO 0.55 -0.35 -0.02 -1.64 -1.52 0.00 0.00 175.55 172.56 3hk9 s MET 220 N -2.60 3.03 0.17 -3.49 -1.94 -0.85 -2.08 119.30 111.55 3hk9 s MET 220 Ca 0.12 -0.45 0.03 0.00 -1.71 0.00 0.00 55.69 53.67 3hk9 s MET 220 Cb 0.02 -2.77 -0.05 0.00 2.01 0.00 0.00 34.83 34.04 3hk9 s MET 220 CO -0.04 0.63 -0.04 0.00 -0.01 0.00 0.00 175.02 175.56 3hk9 s ALA 221 N -0.68 1.49 -0.13 3.03 0.00 -0.39 0.43 121.76 125.50 3hk9 s ALA 221 Ca 0.11 -1.59 -0.29 0.00 0.00 0.00 0.00 51.96 50.19 3hk9 s ALA 221 Cb -0.12 0.32 0.09 0.00 0.00 0.00 0.00 23.12 23.41 3hk9 s ALA 221 CO 0.02 -0.21 0.78 0.54 0.00 0.00 0.00 175.76 176.89 3hk9 s VAL 222 N -3.47 0.00 -0.13 0.00 0.11 -0.72 -1.01 120.40 115.17 3hk9 s VAL 222 Ca 0.22 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.23 3hk9 s VAL 222 Cb 0.05 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.86 3hk9 s VAL 222 CO 0.03 0.00 -0.01 -0.94 -3.33 0.00 0.00 175.10 170.86 3hk9 s SER 223 N -0.75 5.11 0.20 3.54 1.04 -1.26 -1.40 113.70 120.17 3hk9 s SER 223 Ca -0.06 0.01 0.11 0.00 0.48 0.00 0.00 55.95 56.49 3hk9 s SER 223 Cb -0.01 -1.68 -0.04 0.00 0.10 0.00 0.00 66.02 64.38 3hk9 s SER 223 CO 0.05 0.25 -0.21 -0.76 0.98 0.00 0.00 173.24 173.55 3hk9 s LEU 224 N -0.13 2.47 0.73 2.42 1.43 -0.01 -4.93 118.68 120.65 3hk9 s LEU 224 Ca 0.04 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 52.13 3hk9 s LEU 224 Cb -0.13 -1.05 0.03 0.00 0.03 0.00 0.00 46.19 45.07 3hk9 s LEU 224 CO 0.02 0.06 1.07 -2.16 0.23 0.00 0.00 176.35 175.57 3hk9 s PRO 225 N -2.88 2.66 0.26 1.29 0.04 -1.25 -1.20 135.00 133.92 3hk9 s PRO 225 Ca 0.21 0.79 0.20 0.00 0.04 0.00 0.00 61.00 62.24 3hk9 s PRO 225 Cb -0.07 -1.97 0.99 0.00 0.04 0.00 0.00 34.50 33.50 3hk9 s PRO 225 CO 0.10 -1.25 1.61 -0.35 0.04 0.00 0.00 177.00 177.15 3hk9 n PRO 226 N -3.21 0.14 -0.16 0.56 -0.04 -1.26 -1.28 135.00 129.75 3hk9 n PRO 226 Ca 0.07 0.55 0.08 0.00 -0.04 0.00 0.00 63.50 64.16 3hk9 n PRO 226 Cb 0.55 -1.88 0.26 0.00 -0.04 0.00 0.00 33.50 32.39 3hk9 n PRO 226 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3hk9 n THR 227 N -2.16 0.42 -1.63 0.52 -2.24 -1.26 -4.03 114.28 103.90 3hk9 n THR 227 Ca -0.00 -0.49 -0.47 0.00 -2.27 0.00 0.00 64.05 60.82 3hk9 n THR 227 Cb 0.10 0.36 -0.04 0.00 -2.10 0.00 0.00 70.33 68.65 3hk9 n THR 227 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3hk9 n PHE 228 N 0.61 1.80 -3.94 4.78 7.35 -0.40 -5.00 117.46 122.66 3hk9 n PHE 228 Ca 0.15 0.52 -0.10 0.00 -0.76 0.00 0.00 57.45 57.26 3hk9 n PHE 228 Cb 0.36 -2.39 -0.10 0.00 0.35 0.00 0.00 39.48 37.69 3hk9 n PHE 228 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 3hk9 s SER 229 N 0.31 0.18 -0.28 -2.13 0.01 -1.26 -4.72 113.70 105.81 3hk9 s SER 229 Ca 0.74 -0.47 -0.18 0.00 1.31 0.00 0.00 55.95 57.34 3hk9 s SER 229 Cb -0.76 0.18 0.10 0.00 0.21 0.00 0.00 66.02 65.74 3hk9 s SER 229 CO 0.48 -0.41 0.80 0.12 0.41 0.00 0.00 173.24 174.64 3hk9 s PHE 230 N -2.03 -0.85 0.81 2.43 2.19 -1.26 -4.41 117.98 114.87 3hk9 s PHE 230 Ca -0.10 1.76 -0.11 0.00 0.33 0.00 0.00 56.93 58.81 3hk9 s PHE 230 Cb -0.05 0.48 0.08 0.00 -1.31 0.00 0.00 43.02 42.23 3hk9 s PHE 230 CO -0.02 -0.42 1.13 -2.14 1.83 0.00 0.00 175.22 175.60 3hk9 s PRO 231 N 1.25 1.81 -0.22 10.12 0.02 -1.26 -4.18 135.00 142.55 3hk9 s PRO 231 Ca -0.07 1.39 -0.12 0.00 0.02 0.00 0.00 61.00 62.23 3hk9 s PRO 231 Cb -0.05 -1.83 0.07 0.00 0.02 0.00 0.00 34.50 32.72 3hk9 s PRO 231 CO -0.14 -2.01 0.53 -2.00 -0.33 0.00 0.00 177.00 173.04 3hk9 s GLU 232 N -4.64 0.52 -1.37 5.54 2.12 -1.26 -5.06 118.70 114.54 3hk9 s GLU 232 Ca 0.65 1.01 -0.16 0.00 0.36 0.00 0.00 54.97 56.84 3hk9 s GLU 232 Cb -0.21 0.12 0.04 0.00 0.26 0.00 0.00 34.13 34.34 3hk9 s GLU 232 CO 0.54 -0.17 2.03 0.39 -0.54 0.00 0.00 175.26 177.52 3hk9 n GLU 233 N 4.45 2.91 -4.10 4.30 -0.58 -1.26 -3.72 120.64 122.63 3hk9 n GLU 233 Ca -0.20 -2.82 -0.12 0.00 -0.42 0.00 0.00 57.16 53.60 3hk9 n GLU 233 Cb 0.56 -3.36 -0.07 0.00 -0.57 0.00 0.00 31.44 28.00 3hk9 n GLU 233 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3hk9 s SER 234 N 3.71 0.27 0.21 1.62 1.04 -1.26 -5.00 113.70 114.30 3hk9 s SER 234 Ca 0.50 -1.23 -0.09 0.00 0.48 0.00 0.00 55.95 55.61 3hk9 s SER 234 Cb 0.10 0.53 0.23 0.00 0.10 0.00 0.00 66.02 66.98 3hk9 s SER 234 CO -0.01 -1.07 1.84 0.78 0.98 0.00 0.00 173.24 175.75 3hk9 h ASN 235 N 2.34 0.70 -0.39 7.02 2.35 -1.92 0.30 115.58 125.98 3hk9 h ASN 235 Ca -0.30 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.42 3hk9 h ASN 235 Cb 1.25 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 39.47 3hk9 h ASN 235 CO 0.42 0.47 0.07 -0.09 -1.65 0.00 0.00 177.43 176.65 3hk9 h ARG 236 N 0.83 0.64 -0.58 0.81 2.43 -1.91 0.14 114.38 116.75 3hk9 h ARG 236 Ca 0.30 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 3hk9 h ARG 236 Cb 0.09 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 3hk9 h ARG 236 CO -0.14 0.69 0.30 0.78 -1.51 0.00 0.00 179.97 180.09 3hk9 h GLY 237 N 0.49 0.88 1.26 2.80 0.00 -1.53 -1.37 103.07 105.61 3hk9 h GLY 237 Ca 0.12 -0.42 -0.21 0.00 0.00 0.00 0.00 47.33 46.82 3hk9 h GLY 237 CO 0.01 0.40 -0.74 3.21 0.00 0.00 0.00 176.54 179.42 3hk9 h ARG 238 N 0.79 0.74 -0.50 4.80 3.08 -0.85 -2.29 114.38 120.14 3hk9 h ARG 238 Ca 0.20 -0.58 -0.08 0.00 0.07 0.00 0.00 59.98 59.60 3hk9 h ARG 238 Cb 0.07 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 3hk9 h ARG 238 CO -0.03 1.19 0.00 0.82 -1.07 0.00 0.00 179.97 180.88 3hk9 h ILE 239 N 0.51 1.25 -0.19 2.04 2.04 -0.61 0.13 117.51 122.69 3hk9 h ILE 239 Ca -0.04 -1.03 -0.09 0.00 1.00 0.00 0.00 64.86 64.70 3hk9 h ILE 239 Cb 1.35 0.86 -0.00 0.00 -0.74 0.00 0.00 36.82 38.29 3hk9 h ILE 239 CO 0.15 0.37 -0.23 0.40 0.00 0.00 0.00 178.15 178.84 3hk9 h ILE 240 N 0.78 1.34 0.32 -0.67 2.04 -1.26 -0.45 117.51 119.61 3hk9 h ILE 240 Ca 0.15 -1.41 -0.02 0.00 1.00 0.00 0.00 64.86 64.58 3hk9 h ILE 240 Cb 0.47 1.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 3hk9 h ILE 240 CO 0.02 0.43 -0.15 -0.09 0.00 0.00 0.00 178.15 178.35 3hk9 h ARG 241 N 0.14 -0.42 0.00 2.37 2.43 -1.26 -1.70 114.38 115.94 3hk9 h ARG 241 Ca 0.02 0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.12 3hk9 h ARG 241 Cb 0.78 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 3hk9 h ARG 241 CO 0.05 -0.10 -0.56 -0.44 -1.51 0.00 0.00 179.97 177.41 3hk9 h ASP 242 N -0.76 0.00 0.00 -3.80 3.32 -0.85 -3.40 116.42 110.92 3hk9 h ASP 242 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 3hk9 h ASP 242 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 3hk9 h ASP 242 CO 0.07 0.47 -0.01 0.00 -1.72 0.00 0.00 179.24 178.05 3hk9 h LEU 244 N -0.01 -1.53 0.16 0.00 7.12 -1.20 -1.16 115.31 118.68 3hk9 h LEU 244 Ca 0.00 0.18 -0.01 0.00 0.13 0.00 0.00 57.88 58.18 3hk9 h LEU 244 Cb 0.01 0.59 -0.00 0.00 -0.53 0.00 0.00 40.66 40.73 3hk9 h LEU 244 CO 0.00 -0.49 -0.08 -0.07 -0.13 0.00 0.00 178.44 177.67 3hk9 h LEU 245 N -0.60 -0.20 -0.93 2.25 3.38 -1.56 0.29 115.31 117.94 3hk9 h LEU 245 Ca 0.04 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.07 3hk9 h LEU 245 Cb 0.69 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 3hk9 h LEU 245 CO -0.37 -0.14 0.59 -0.65 0.09 0.00 0.00 178.44 177.96 3hk9 h PRO 246 N -0.22 1.06 -0.09 1.13 0.11 -1.75 0.40 132.00 132.63 3hk9 h PRO 246 Ca -0.02 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 3hk9 h PRO 246 Cb 0.18 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.04 3hk9 h PRO 246 CO 0.03 0.70 0.02 0.28 -0.21 0.00 0.00 178.00 178.82 3hk9 h VAL 247 N 1.10 1.22 -0.76 3.15 2.07 -0.93 -2.32 116.25 119.78 3hk9 h VAL 247 Ca 0.39 -0.67 0.09 0.00 0.82 0.00 0.00 66.70 67.34 3hk9 h VAL 247 Cb 0.13 1.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.31 3hk9 h VAL 247 CO -0.16 0.19 0.41 0.00 0.02 0.00 0.00 177.57 178.03 3hk9 h ALA 248 N 0.78 1.07 -0.16 1.67 0.00 0.15 -2.08 119.26 120.69 3hk9 h ALA 248 Ca 0.03 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3hk9 h ALA 248 Cb 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3hk9 h ALA 248 CO 0.00 0.01 0.05 1.49 0.00 0.00 0.00 179.25 180.81 3hk9 h GLU 249 N 0.68 0.24 -0.63 0.00 4.81 -0.83 0.76 114.58 119.61 3hk9 h GLU 249 Ca 0.37 -0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.62 3hk9 h GLU 249 Cb 0.37 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.66 3hk9 h GLU 249 CO -0.26 0.35 0.33 -0.22 -0.73 0.00 0.00 179.01 178.48 3hk9 h LYS 250 N 0.09 0.58 -0.22 1.92 3.64 -0.96 -1.70 116.57 119.93 3hk9 h LYS 250 Ca 0.05 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3hk9 h LYS 250 Cb 0.20 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3hk9 h LYS 250 CO -0.00 0.39 0.00 0.72 -2.27 0.00 0.00 179.45 178.28 3hk9 n HIS 251 N -4.84 0.28 -3.92 1.91 8.25 -0.82 -4.93 115.22 111.14 3hk9 n HIS 251 Ca 0.08 -0.14 -0.28 0.00 -0.26 0.00 0.00 57.72 57.12 3hk9 n HIS 251 Cb 0.19 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.31 3hk9 n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3hk9 n ASN 252 N 0.44 -2.83 -4.46 0.41 4.05 -0.06 -4.95 115.26 107.85 3hk9 n ASN 252 Ca 0.16 -0.87 -0.35 0.00 0.45 0.00 0.00 54.58 53.97 3hk9 n ASN 252 Cb 0.34 -3.58 -0.12 0.00 1.23 0.00 0.00 39.78 37.65 3hk9 n ASN 252 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3hk9 s ILE 253 N -3.51 3.94 0.76 -1.44 1.01 0.06 -4.88 121.20 117.14 3hk9 s ILE 253 Ca 0.39 -0.32 -0.13 0.00 0.00 0.00 0.00 60.65 60.59 3hk9 s ILE 253 Cb -0.20 -2.77 0.05 0.00 0.01 0.00 0.00 42.46 39.55 3hk9 s ILE 253 CO 0.85 0.45 1.14 -2.84 0.00 0.00 0.00 174.94 174.54 3hk9 s PRO 254 N 0.82 2.14 -0.24 2.79 0.02 -1.26 -4.60 135.00 134.67 3hk9 s PRO 254 Ca 0.00 1.47 -0.04 0.00 0.02 0.00 0.00 61.00 62.45 3hk9 s PRO 254 Cb -0.14 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.52 3hk9 s PRO 254 CO 0.02 -1.78 -0.03 0.12 -0.33 0.00 0.00 177.00 175.00 3hk9 s PHE 255 N -2.44 3.01 -0.18 6.54 5.36 0.77 -2.00 117.98 129.04 3hk9 s PHE 255 Ca 0.67 -1.10 -0.14 0.00 -0.96 0.00 0.00 56.93 55.40 3hk9 s PHE 255 Cb -0.22 -2.12 -0.04 0.00 -0.34 0.00 0.00 43.02 40.30 3hk9 s PHE 255 CO 0.49 -0.60 0.32 0.00 -1.46 0.00 0.00 175.22 173.97 3hk9 s ALA 256 N 1.44 3.58 -0.14 11.12 0.00 0.17 -1.25 121.76 136.67 3hk9 s ALA 256 Ca 0.04 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.50 3hk9 s ALA 256 Cb -0.15 -2.48 0.02 0.00 0.00 0.00 0.00 23.12 20.51 3hk9 s ALA 256 CO -0.03 -0.08 -0.17 -1.64 0.00 0.00 0.00 175.76 173.84 3hk9 s MET 257 N 0.83 2.57 -0.51 0.00 1.00 0.40 -1.76 119.30 121.82 3hk9 s MET 257 Ca 0.17 -0.68 -0.04 0.00 0.00 0.00 0.00 55.69 55.14 3hk9 s MET 257 Cb -0.14 -2.22 0.13 0.00 0.00 0.00 0.00 34.83 32.61 3hk9 s MET 257 CO 0.05 -0.15 0.33 -1.64 0.00 0.00 0.00 175.02 173.61 3hk9 s MET 258 N 1.19 2.31 0.05 2.03 -1.94 -0.50 -2.44 119.30 120.00 3hk9 s MET 258 Ca -0.00 -2.12 -0.06 0.00 -1.71 0.00 0.00 55.69 51.79 3hk9 s MET 258 Cb -0.14 -3.69 -0.05 0.00 2.01 0.00 0.00 34.83 32.96 3hk9 s MET 258 CO -0.07 -1.13 0.30 0.42 -0.01 0.00 0.00 175.02 174.53 3hk9 s ILE 259 N 0.64 5.25 0.00 2.53 1.01 -0.84 -0.83 121.20 128.96 3hk9 s ILE 259 Ca 0.12 0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.91 3hk9 s ILE 259 Cb -0.22 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.66 3hk9 s ILE 259 CO -0.04 0.28 0.00 0.61 0.00 0.00 0.00 174.94 175.79 3hk9 n GLY 260 N 0.85 1.56 3.72 6.18 0.00 -0.34 -0.29 105.19 116.86 3hk9 n GLY 260 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 3hk9 n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hk9 s VAL 261 N -2.00 4.83 -0.56 1.61 0.11 -1.08 -1.75 120.40 121.56 3hk9 s VAL 261 Ca 0.00 1.87 -0.07 0.00 -2.93 0.00 0.00 61.98 60.85 3hk9 s VAL 261 Cb 0.00 -4.23 0.15 0.00 -1.53 0.00 0.00 36.38 30.77 3hk9 s VAL 261 CO 0.00 0.24 0.41 -0.75 -3.33 0.00 0.00 175.10 171.67 3hk9 s LYS 262 N 0.64 2.57 0.34 1.54 2.20 -0.14 -3.87 119.74 123.03 3hk9 s LYS 262 Ca 0.46 -2.13 -0.29 0.00 -0.36 0.00 0.00 55.97 53.66 3hk9 s LYS 262 Cb -0.21 -3.87 -0.11 0.00 -1.51 0.00 0.00 37.83 32.13 3hk9 s LYS 262 CO 0.25 -1.18 1.51 0.15 -0.36 0.00 0.00 175.35 175.72 3hk9 s LYS 263 N 0.68 4.13 -1.30 4.03 -0.14 -1.26 -0.53 119.74 125.36 3hk9 s LYS 263 Ca 0.12 2.54 -0.13 0.00 -1.36 0.00 0.00 55.97 57.14 3hk9 s LYS 263 Cb -0.22 -3.00 0.00 0.00 -1.68 0.00 0.00 37.83 32.94 3hk9 s LYS 263 CO -0.03 -0.54 0.55 0.54 -0.76 0.00 0.00 175.35 175.11 3hk9 n ARG 264 N 1.09 -1.90 0.09 1.68 1.74 -1.20 -4.87 116.66 113.29 3hk9 n ARG 264 Ca 0.03 0.34 0.13 0.00 -0.77 0.00 0.00 57.85 57.58 3hk9 n ARG 264 Cb 0.39 -3.99 0.45 0.00 -1.02 0.00 0.00 32.46 28.29 3hk9 n ARG 264 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 3hk9 n VAL 265 N -4.45 0.60 -3.32 1.55 0.24 0.58 -3.80 118.33 109.75 3hk9 n VAL 265 Ca -0.21 -0.08 -0.25 0.00 -2.04 0.00 0.00 64.34 61.77 3hk9 n VAL 265 Cb 0.64 -0.75 -0.09 0.00 -1.47 0.00 0.00 33.84 32.16 3hk9 n VAL 265 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 3hk9 n HIS 266 N -2.11 -1.02 -0.34 6.34 -0.00 -1.01 -5.03 115.22 112.05 3hk9 n HIS 266 Ca 0.05 -3.23 0.23 0.00 -0.00 0.00 0.00 57.72 54.77 3hk9 n HIS 266 Cb 0.35 0.24 0.50 0.00 -0.00 0.00 0.00 29.99 31.07 3hk9 n HIS 266 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3hk9 h PRO 267 N 5.29 0.38 0.00 1.57 0.13 -1.82 -1.94 132.00 135.62 3hk9 h PRO 267 Ca 0.22 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.31 3hk9 h PRO 267 Cb 0.92 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 3hk9 h PRO 267 CO 0.37 0.25 -0.10 0.00 -0.23 0.00 0.00 178.00 178.29 3hk9 h ALA 268 N 1.64 1.44 0.00 -0.56 0.00 -1.96 -1.89 119.26 117.94 3hk9 h ALA 268 Ca 0.63 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.45 3hk9 h ALA 268 Cb 1.56 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.33 3hk9 h ALA 268 CO -0.35 0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.31 3hk9 n LEU 269 N -3.85 0.00 0.00 0.00 4.77 -0.73 -4.96 117.00 112.24 3hk9 n LEU 269 Ca -0.02 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 3hk9 n LEU 269 Cb 0.20 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3hk9 n LEU 269 CO 0.31 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3hk9 n GLY 270 N 0.78 3.55 0.26 -0.72 0.00 -0.71 -1.81 105.19 106.53 3hk9 n GLY 270 Ca 0.19 -0.12 0.17 0.00 0.00 0.00 0.00 46.02 46.25 3hk9 n GLY 270 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hk9 h ASP 271 N 0.98 0.00 -0.50 1.61 3.32 -1.93 -0.94 116.42 118.95 3hk9 h ASP 271 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hk9 h ASP 271 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3hk9 h ASP 271 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3hk9 n ALA 272 N -1.93 2.42 -1.01 3.45 0.00 -0.75 -4.37 120.51 118.32 3hk9 n ALA 272 Ca -0.02 -0.89 0.02 0.00 0.00 0.00 0.00 53.44 52.54 3hk9 n ALA 272 Cb 0.06 -0.96 0.33 0.00 0.00 0.00 0.00 19.45 18.87 3hk9 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk9 n GLY 273 N 1.32 3.56 3.88 0.00 0.00 -0.36 -4.84 105.19 108.76 3hk9 n GLY 273 Ca 0.17 -1.00 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 3hk9 n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hk9 s ASP 274 N -1.20 6.48 0.01 1.61 1.01 -1.26 -0.30 116.67 123.02 3hk9 s ASP 274 Ca 0.52 0.54 0.00 0.00 0.71 0.00 0.00 52.55 54.32 3hk9 s ASP 274 Cb 0.41 -2.09 0.00 0.00 1.01 0.00 0.00 42.92 42.26 3hk9 s ASP 274 CO 0.13 0.29 0.01 0.33 0.21 0.00 0.00 175.17 176.13 3hk9 n PHE 275 N 1.30 -1.18 -4.10 4.23 7.35 0.31 -4.92 117.46 120.45 3hk9 n PHE 275 Ca -0.13 -0.05 -0.10 0.00 -0.76 0.00 0.00 57.45 56.41 3hk9 n PHE 275 Cb 0.53 -0.01 -0.10 0.00 0.35 0.00 0.00 39.48 40.25 3hk9 n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3hk9 s VAL 276 N -0.25 0.44 -0.04 -2.13 0.11 -1.26 -0.96 120.40 116.29 3hk9 s VAL 276 Ca 0.01 -1.59 -0.23 0.00 -2.93 0.00 0.00 61.98 57.23 3hk9 s VAL 276 Cb -0.00 -1.23 0.05 0.00 -1.53 0.00 0.00 36.38 33.66 3hk9 s VAL 276 CO 0.00 -0.77 0.51 -0.83 -3.33 0.00 0.00 175.10 170.68 3hk9 s GLY 277 N -2.51 -0.38 0.24 6.54 0.00 -0.72 -4.85 107.32 105.64 3hk9 s GLY 277 Ca 0.02 0.89 -0.30 0.00 0.00 0.00 0.00 44.72 45.33 3hk9 s GLY 277 CO -0.05 0.60 1.17 1.25 0.00 0.00 0.00 173.10 176.07 3hk9 s LYS 278 N -1.17 4.54 0.23 2.90 2.20 -1.26 -4.50 119.74 122.69 3hk9 s LYS 278 Ca -0.12 1.88 0.06 0.00 -0.36 0.00 0.00 55.97 57.44 3hk9 s LYS 278 Cb -0.03 -3.20 -0.04 0.00 -1.51 0.00 0.00 37.83 33.06 3hk9 s LYS 278 CO 0.07 0.03 0.22 0.00 -0.36 0.00 0.00 175.35 175.31 3hk9 s ALA 279 N -0.66 3.65 0.42 3.13 0.00 -1.26 -4.80 121.76 122.24 3hk9 s ALA 279 Ca 0.49 -1.35 -0.22 0.00 0.00 0.00 0.00 51.96 50.88 3hk9 s ALA 279 Cb -0.33 -1.39 -0.11 0.00 0.00 0.00 0.00 23.12 21.29 3hk9 s ALA 279 CO 0.40 0.29 0.95 0.45 0.00 0.00 0.00 175.76 177.86 3hk9 s SER 280 N -3.74 6.97 0.00 0.00 0.15 -1.26 -4.96 113.70 110.86 3hk9 s SER 280 Ca 0.33 1.71 0.25 0.00 0.70 0.00 0.00 55.95 58.94 3hk9 s SER 280 Cb -0.08 -2.54 0.48 0.00 -1.71 0.00 0.00 66.02 62.16 3hk9 s SER 280 CO 0.25 -0.34 1.40 0.23 1.20 0.00 0.00 173.24 175.99 3hk9 n MET 281 N -0.52 1.18 -0.08 5.44 2.81 -1.26 -4.52 117.12 120.17 3hk9 n MET 281 Ca 0.06 -0.83 -0.07 0.00 -1.81 0.00 0.00 57.70 55.05 3hk9 n MET 281 Cb 0.54 -1.48 -0.00 0.00 -0.71 0.00 0.00 33.22 31.56 3hk9 n MET 281 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3hk9 h ASP 282 N 2.04 -0.37 -0.83 7.83 3.32 -1.93 0.27 116.42 126.73 3hk9 h ASP 282 Ca 0.00 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 3hk9 h ASP 282 Cb 0.63 0.22 -0.04 0.00 0.22 0.00 0.00 39.33 40.37 3hk9 h ASP 282 CO 0.00 -0.14 0.47 1.23 -1.72 0.00 0.00 179.24 179.09 3hk9 h GLY 283 N -0.05 1.23 1.06 2.75 0.00 -1.80 -0.10 103.07 106.16 3hk9 h GLY 283 Ca 0.15 -0.54 -0.17 0.00 0.00 0.00 0.00 47.33 46.77 3hk9 h GLY 283 CO -0.34 0.52 -0.51 -2.08 0.00 0.00 0.00 176.54 174.13 3hk9 h VAL 284 N 1.16 1.30 -0.21 4.60 2.07 -1.74 -1.27 116.25 122.16 3hk9 h VAL 284 Ca 0.30 -1.72 0.03 0.00 0.82 0.00 0.00 66.70 66.13 3hk9 h VAL 284 Cb 0.00 1.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 3hk9 h VAL 284 CO -0.05 0.55 0.03 -0.08 0.02 0.00 0.00 177.57 178.04 3hk9 h GLU 285 N 0.49 0.11 -0.09 1.57 4.81 -0.66 -1.43 114.58 119.38 3hk9 h GLU 285 Ca 0.00 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3hk9 h GLU 285 Cb 1.12 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 3hk9 h GLU 285 CO 0.11 0.07 0.05 1.25 -0.73 0.00 0.00 179.01 179.77 3hk9 h HIS 286 N 0.11 0.12 -0.58 0.92 2.76 -0.97 -1.24 115.15 116.27 3hk9 h HIS 286 Ca 0.09 -0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.34 3hk9 h HIS 286 Cb 0.10 -0.04 -0.06 0.00 1.55 0.00 0.00 27.41 28.96 3hk9 h HIS 286 CO -0.15 0.12 0.23 -0.07 -1.30 0.00 0.00 177.93 176.77 3hk9 h LEU 287 N 0.08 0.26 -0.50 0.26 3.38 -1.03 0.17 115.31 117.93 3hk9 h LEU 287 Ca 0.03 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 3hk9 h LEU 287 Cb 0.04 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3hk9 h LEU 287 CO -0.01 0.17 0.11 -0.07 0.09 0.00 0.00 178.44 178.74 3hk9 h LEU 288 N 0.43 0.77 -0.01 1.67 3.38 -1.04 -1.90 115.31 118.61 3hk9 h LEU 288 Ca 0.28 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3hk9 h LEU 288 Cb 0.31 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3hk9 h LEU 288 CO -0.26 0.81 -0.03 -0.09 0.09 0.00 0.00 178.44 178.95 3hk9 h ARG 289 N 0.69 0.04 0.00 1.13 2.43 -0.83 -3.32 114.38 114.51 3hk9 h ARG 289 Ca 0.16 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3hk9 h ARG 289 Cb 0.34 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3hk9 h ARG 289 CO 0.00 0.66 0.00 0.93 -1.51 0.00 0.00 179.97 180.06 3hk9 h GLU 290 N -0.59 0.00 -2.18 0.20 4.39 -1.05 -3.34 114.58 112.01 3hk9 h GLU 290 Ca -0.00 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.13 3hk9 h GLU 290 Cb 0.67 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 28.90 3hk9 h GLU 290 CO 0.01 0.00 -0.77 0.66 -1.16 0.00 0.00 179.01 177.75 3hk9 n TYR 291 N -2.50 2.86 0.30 4.33 4.01 -0.71 -4.92 117.16 120.51 3hk9 n TYR 291 Ca 0.04 -3.97 0.18 0.00 -0.16 0.00 0.00 57.90 53.99 3hk9 n TYR 291 Cb 0.36 -0.48 1.00 0.00 -0.31 0.00 0.00 39.34 39.91 3hk9 n TYR 291 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3hk9 h PRO 292 N 3.43 0.00 -0.05 -0.72 0.13 -1.70 -1.86 132.00 131.24 3hk9 h PRO 292 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3hk9 h PRO 292 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 3hk9 h PRO 292 CO 0.74 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.60 3hk9 n ASN 293 N -3.47 2.04 -4.93 1.44 4.13 -1.26 -4.86 115.26 108.35 3hk9 n ASN 293 Ca -0.02 -1.69 -0.27 0.00 1.68 0.00 0.00 54.58 54.29 3hk9 n ASN 293 Cb 0.16 -0.02 -0.03 0.00 -1.54 0.00 0.00 39.78 38.35 3hk9 n ASN 293 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3hk9 s ASN 294 N -1.94 6.25 -0.08 6.41 -0.87 -0.70 -4.81 114.94 119.20 3hk9 s ASN 294 Ca 0.35 0.15 0.01 0.00 -1.57 0.00 0.00 52.86 51.80 3hk9 s ASN 294 Cb 0.20 -1.87 -0.03 0.00 -0.02 0.00 0.00 41.25 39.54 3hk9 s ASN 294 CO 0.32 0.07 -0.10 -0.54 -2.57 0.00 0.00 177.10 174.28 3hk9 s LYS 295 N -3.11 2.88 -0.07 -0.60 1.02 -1.26 -4.86 119.74 113.74 3hk9 s LYS 295 Ca 0.34 -0.62 0.04 0.00 0.02 0.00 0.00 55.97 55.75 3hk9 s LYS 295 Cb -0.11 -2.56 0.00 0.00 -0.52 0.00 0.00 37.83 34.64 3hk9 s LYS 295 CO 0.28 0.53 -0.19 -0.06 -0.92 0.00 0.00 175.35 174.98 3hk9 s PHE 296 N -0.46 2.02 -0.20 3.18 0.08 -0.05 -0.16 117.98 122.40 3hk9 s PHE 296 Ca 0.06 -0.71 -0.05 0.00 0.12 0.00 0.00 56.93 56.35 3hk9 s PHE 296 Cb -0.12 -1.37 -0.02 0.00 -0.57 0.00 0.00 43.02 40.93 3hk9 s PHE 296 CO 0.02 -0.28 -0.00 -0.51 -0.10 0.00 0.00 175.22 174.35 3hk9 s LEU 297 N 0.26 3.27 -0.01 -0.37 1.43 -0.38 -0.60 118.68 122.28 3hk9 s LEU 297 Ca -0.11 -0.19 0.02 0.00 -1.03 0.00 0.00 54.13 52.82 3hk9 s LEU 297 Cb -0.15 -1.83 -0.00 0.00 0.03 0.00 0.00 46.19 44.24 3hk9 s LEU 297 CO 0.05 0.07 -0.07 -0.69 0.23 0.00 0.00 176.35 175.94 3hk9 s VAL 298 N 0.94 0.58 -0.04 -1.59 1.01 -0.70 -0.46 120.40 120.15 3hk9 s VAL 298 Ca 0.01 -0.30 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 3hk9 s VAL 298 Cb -0.14 -0.50 0.01 0.00 0.00 0.00 0.00 36.38 35.75 3hk9 s VAL 298 CO 0.02 0.17 0.10 0.28 0.00 0.00 0.00 175.10 175.67 3hk9 s THR 299 N -0.11 -0.01 0.17 3.92 -1.32 -1.02 -1.69 115.64 115.59 3hk9 s THR 299 Ca 0.02 0.02 0.11 0.00 -1.21 0.00 0.00 61.69 60.63 3hk9 s THR 299 Cb -0.04 -0.15 -0.04 0.00 -1.51 0.00 0.00 72.50 70.76 3hk9 s THR 299 CO -0.00 0.01 -0.24 -0.04 -2.21 0.00 0.00 174.62 172.13 3hk9 s MET 300 N 0.16 1.46 0.06 7.08 -1.94 -1.26 -1.99 119.30 122.87 3hk9 s MET 300 Ca -0.01 -1.47 0.14 0.00 -1.71 0.00 0.00 55.69 52.65 3hk9 s MET 300 Cb -0.02 -1.80 -0.14 0.00 2.01 0.00 0.00 34.83 34.87 3hk9 s MET 300 CO -0.00 0.40 0.90 1.25 -0.01 0.00 0.00 175.02 177.55 3hk9 h LEU 301 N 3.39 0.00 -9.57 -0.03 5.85 -0.96 -3.42 115.31 110.56 3hk9 h LEU 301 Ca -0.47 0.00 -0.54 0.00 0.84 0.00 0.00 57.88 57.71 3hk9 h LEU 301 Cb 1.20 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.19 3hk9 h LEU 301 CO 0.46 0.72 0.18 -0.55 -0.34 0.00 0.00 178.44 178.91 3hk9 s SER 302 N -6.04 7.26 0.31 1.25 0.15 -1.26 -4.56 113.70 110.82 3hk9 s SER 302 Ca -0.02 1.51 -0.01 0.00 0.70 0.00 0.00 55.95 58.13 3hk9 s SER 302 Cb 0.08 -2.48 0.49 0.00 -1.71 0.00 0.00 66.02 62.41 3hk9 s SER 302 CO 0.81 0.05 1.97 -0.09 1.20 0.00 0.00 173.24 177.18 3hk9 h ARG 303 N 5.40 1.01 0.00 5.44 2.43 -1.95 -2.10 114.38 124.60 3hk9 h ARG 303 Ca -0.44 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 3hk9 h ARG 303 Cb 1.21 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 3hk9 h ARG 303 CO 0.70 0.68 0.00 0.39 -1.51 0.00 0.00 179.97 180.23 3hk9 n GLU 304 N -4.41 0.05 0.02 0.20 4.71 -1.26 -2.44 120.64 117.51 3hk9 n GLU 304 Ca 0.08 0.23 0.11 0.00 -0.01 0.00 0.00 57.16 57.57 3hk9 n GLU 304 Cb 0.04 -1.50 -0.09 0.00 -1.01 0.00 0.00 31.44 28.88 3hk9 n GLU 304 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3hk9 n ASN 305 N -1.45 0.43 -0.20 1.62 5.03 -0.79 -4.65 115.26 115.25 3hk9 n ASN 305 Ca 0.04 -0.16 -0.04 0.00 0.87 0.00 0.00 54.58 55.30 3hk9 n ASN 305 Cb 0.15 1.31 0.07 0.00 -1.02 0.00 0.00 39.78 40.29 3hk9 n ASN 305 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 3hk9 h GLN 306 N 0.00 0.63 -0.20 3.52 1.08 -1.49 -2.03 115.11 116.62 3hk9 h GLN 306 Ca 0.00 -0.04 -0.06 0.00 -1.45 0.00 0.00 58.65 57.10 3hk9 h GLN 306 Cb 0.85 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 28.14 3hk9 h GLN 306 CO 0.00 0.42 -0.12 1.25 -0.95 0.00 0.00 178.83 179.42 3hk9 h HIS 307 N 0.65 0.52 0.00 2.96 2.76 -1.82 -2.76 115.15 117.45 3hk9 h HIS 307 Ca 0.25 -0.14 -0.03 0.00 -2.20 0.00 0.00 60.37 58.26 3hk9 h HIS 307 Cb 0.10 -0.12 -0.00 0.00 1.55 0.00 0.00 27.41 28.94 3hk9 h HIS 307 CO -0.07 0.75 -0.14 1.05 -1.30 0.00 0.00 177.93 178.22 3hk9 h GLU 308 N 0.13 0.00 -0.33 5.26 4.11 -1.84 -1.67 114.58 120.24 3hk9 h GLU 308 Ca 0.04 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.31 3hk9 h GLU 308 Cb 0.63 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 3hk9 h GLU 308 CO 0.03 0.14 -0.44 1.25 0.07 0.00 0.00 179.01 180.06 3hk9 h LEU 309 N 0.00 0.94 -0.37 3.06 5.85 -1.26 -0.66 115.31 122.87 3hk9 h LEU 309 Ca -0.00 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 3hk9 h LEU 309 Cb 0.44 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 3hk9 h LEU 309 CO 0.02 1.24 0.21 0.58 -0.34 0.00 0.00 178.44 180.15 3hk9 h VAL 310 N 0.70 1.13 -0.49 1.05 2.07 -1.04 -1.44 116.25 118.23 3hk9 h VAL 310 Ca 0.04 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 3hk9 h VAL 310 Cb 1.03 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 3hk9 h VAL 310 CO 0.10 0.14 0.20 0.58 0.02 0.00 0.00 177.57 178.61 3hk9 h VAL 311 N 0.47 1.18 -0.44 2.57 2.07 -1.21 -1.61 116.25 119.28 3hk9 h VAL 311 Ca 0.13 -0.56 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 3hk9 h VAL 311 Cb 0.04 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 3hk9 h VAL 311 CO -0.02 0.22 0.03 0.25 0.02 0.00 0.00 177.57 178.07 3hk9 h LEU 312 N 0.70 0.66 -1.39 2.57 5.85 -0.41 -1.73 115.31 121.56 3hk9 h LEU 312 Ca 0.17 -0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 3hk9 h LEU 312 Cb 0.14 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3hk9 h LEU 312 CO -0.02 0.71 -0.25 0.00 -0.34 0.00 0.00 178.44 178.55 3hk9 h ALA 313 N 1.37 1.50 0.00 1.25 0.00 -0.32 -1.47 119.26 121.59 3hk9 h ALA 313 Ca 0.14 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 3hk9 h ALA 313 Cb 0.37 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3hk9 h ALA 313 CO 0.01 0.37 -0.27 0.00 0.00 0.00 0.00 179.25 179.36 3hk9 h ARG 314 N 0.08 0.00 0.23 0.00 3.08 -0.85 -3.21 114.38 113.71 3hk9 h ARG 314 Ca 0.01 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.76 3hk9 h ARG 314 Cb 0.49 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.57 3hk9 h ARG 314 CO 0.03 0.27 -1.33 0.87 -1.07 0.00 0.00 179.97 178.75 3hk9 h LYS 315 N 0.00 0.49 -4.72 0.04 1.79 -1.07 -3.46 116.57 109.64 3hk9 h LYS 315 Ca -0.00 -0.84 -0.60 0.00 -2.18 0.00 0.00 60.65 57.03 3hk9 h LYS 315 Cb 0.60 0.31 -0.35 0.00 -1.58 0.00 0.00 32.23 31.21 3hk9 h LYS 315 CO 0.04 1.40 -0.84 -0.06 -1.08 0.00 0.00 179.45 178.91 3hk9 s PHE 316 N -2.57 2.10 -0.41 -1.35 0.08 -0.98 -4.99 117.98 109.86 3hk9 s PHE 316 Ca -0.10 -1.09 0.26 0.00 0.12 0.00 0.00 56.93 56.12 3hk9 s PHE 316 Cb 0.03 -1.53 0.97 0.00 -0.57 0.00 0.00 43.02 41.93 3hk9 s PHE 316 CO 0.92 -0.58 1.77 0.66 -0.10 0.00 0.00 175.22 177.90 3hk9 h SER 317 N 7.73 0.00 -0.06 1.36 4.64 -1.89 -2.58 113.55 122.75 3hk9 h SER 317 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3hk9 h SER 317 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3hk9 h SER 317 CO 0.51 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.01 3hk9 n ASN 318 N -2.49 0.44 -4.44 4.97 6.94 -1.26 -4.70 115.26 114.73 3hk9 n ASN 318 Ca 0.03 -1.69 -0.34 0.00 -0.02 0.00 0.00 54.58 52.56 3hk9 n ASN 318 Cb 0.31 -0.04 -0.13 0.00 -2.36 0.00 0.00 39.78 37.57 3hk9 n ASN 318 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3hk9 s LEU 319 N -1.35 3.13 -0.26 -4.53 2.96 -0.97 -0.87 118.68 116.78 3hk9 s LEU 319 Ca 0.20 -0.21 0.02 0.00 -0.22 0.00 0.00 54.13 53.92 3hk9 s LEU 319 Cb 0.10 -1.76 0.07 0.00 0.50 0.00 0.00 46.19 45.09 3hk9 s LEU 319 CO 0.15 0.12 -0.06 -0.32 -1.32 0.00 0.00 176.35 174.92 3hk9 s MET 320 N 0.68 1.81 0.19 1.98 -2.45 0.23 -4.93 119.30 116.82 3hk9 s MET 320 Ca -0.02 -1.22 -0.18 0.00 -1.25 0.00 0.00 55.69 53.02 3hk9 s MET 320 Cb -0.15 -2.75 -0.08 0.00 1.25 0.00 0.00 34.83 33.11 3hk9 s MET 320 CO 0.02 -0.64 0.66 0.96 1.05 0.00 0.00 175.02 177.07 3hk9 s ILE 321 N 1.24 4.68 0.04 10.11 -4.36 -1.26 -1.73 121.20 129.92 3hk9 s ILE 321 Ca -0.05 1.11 -0.02 0.00 -0.26 0.00 0.00 60.65 61.43 3hk9 s ILE 321 Cb -0.19 -3.81 -0.02 0.00 1.25 0.00 0.00 42.46 39.68 3hk9 s ILE 321 CO -0.07 0.23 0.01 0.72 0.24 0.00 0.00 174.94 176.08 3hk9 s PHE 322 N -1.49 0.32 0.17 1.37 -0.12 -0.68 -2.44 117.98 115.11 3hk9 s PHE 322 Ca 0.41 -0.69 0.00 0.00 -0.05 0.00 0.00 56.93 56.60 3hk9 s PHE 322 Cb -0.16 -0.24 0.00 0.00 -0.63 0.00 0.00 43.02 41.99 3hk9 s PHE 322 CO 0.20 -0.31 0.00 0.41 -0.05 0.00 0.00 175.22 175.47 3hk9 n GLY 323 N 0.84 -0.93 2.97 1.99 0.00 -0.37 -4.46 105.19 105.24 3hk9 n GLY 323 Ca -0.19 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 3hk9 n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hk9 s TRP 325 N -0.68 3.27 0.00 0.00 -0.00 -1.26 -2.75 118.94 117.51 3hk9 s TRP 325 Ca 0.20 1.08 0.00 0.00 -0.00 0.00 0.00 56.10 57.38 3hk9 s TRP 325 Cb -0.17 -3.57 0.00 0.00 -0.00 0.00 0.00 33.47 29.72 3hk9 s TRP 325 CO -0.06 -1.94 0.00 1.87 -0.00 0.00 0.00 176.95 176.82 3hk9 n TRP 326 N 4.16 0.00 0.61 5.86 -0.00 -1.26 -0.40 117.44 126.41 3hk9 n TRP 326 Ca 0.11 0.00 0.08 0.00 -0.00 0.00 0.00 57.50 57.68 3hk9 n TRP 326 Cb 0.44 0.00 0.35 0.00 -0.00 0.00 0.00 31.31 32.11 3hk9 n TRP 326 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 3hk9 n PHE 327 N 0.00 0.00 0.51 5.87 3.72 -1.26 -1.45 117.46 124.84 3hk9 n PHE 327 Ca 0.00 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.51 3hk9 n PHE 327 Cb 0.00 -0.42 0.04 0.00 -0.94 0.00 0.00 39.48 38.16 3hk9 n PHE 327 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3hk9 n MET 328 N -1.42 0.33 -1.20 -1.08 2.81 0.47 -4.54 117.12 112.48 3hk9 n MET 328 Ca 0.05 0.02 -0.25 0.00 -1.81 0.00 0.00 57.70 55.71 3hk9 n MET 328 Cb 0.16 -1.63 -0.10 0.00 -0.71 0.00 0.00 33.22 30.94 3hk9 n MET 328 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3hk9 n ASN 329 N -2.07 6.80 -4.01 7.83 5.15 -0.53 -3.69 115.26 124.73 3hk9 n ASN 329 Ca 0.02 -2.60 -0.20 0.00 -0.60 0.00 0.00 54.58 51.20 3hk9 n ASN 329 Cb 0.45 -1.46 -0.15 0.00 -0.53 0.00 0.00 39.78 38.09 3hk9 n ASN 329 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 3hk9 s ASN 330 N 1.86 1.23 0.20 1.20 0.01 -1.26 -4.98 114.94 113.20 3hk9 s ASN 330 Ca 0.67 -0.19 -0.09 0.00 -0.71 0.00 0.00 52.86 52.54 3hk9 s ASN 330 Cb 0.27 -0.29 0.29 0.00 0.41 0.00 0.00 41.25 41.93 3hk9 s ASN 330 CO -0.04 0.08 1.17 -2.65 -1.51 0.00 0.00 177.10 174.15 3hk9 n PRO 331 N 3.18 -0.11 -0.28 -0.60 -0.02 -1.26 -0.35 135.00 135.56 3hk9 n PRO 331 Ca -0.17 1.17 -0.00 0.00 -2.02 0.00 0.00 63.50 62.48 3hk9 n PRO 331 Cb 0.55 -1.74 0.20 0.00 -0.02 0.00 0.00 33.50 32.48 3hk9 n PRO 331 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hk9 h GLU 332 N 0.00 1.10 0.20 -0.52 4.57 -1.97 -1.02 114.58 116.93 3hk9 h GLU 332 Ca 0.33 -0.07 -0.29 0.00 -1.18 0.00 0.00 59.36 58.15 3hk9 h GLU 332 Cb 0.51 -0.25 0.02 0.00 -0.16 0.00 0.00 28.75 28.88 3hk9 h GLU 332 CO -0.77 0.73 -1.32 0.82 -1.18 0.00 0.00 179.01 177.29 3hk9 h ILE 333 N 1.14 1.27 -0.80 2.32 1.08 -0.95 -2.99 117.51 118.58 3hk9 h ILE 333 Ca 0.31 -2.59 0.06 0.00 -0.39 0.00 0.00 64.86 62.26 3hk9 h ILE 333 Cb -0.11 3.01 -0.06 0.00 -3.07 0.00 0.00 36.82 36.59 3hk9 h ILE 333 CO -0.07 0.78 0.48 0.40 -0.69 0.00 0.00 178.15 179.05 3hk9 h ILE 334 N -0.06 1.02 0.11 -0.67 2.04 -0.77 0.58 117.51 119.74 3hk9 h ILE 334 Ca -0.24 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 3hk9 h ILE 334 Cb 1.96 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 3hk9 h ILE 334 CO 0.20 0.16 -0.05 -1.13 0.00 0.00 0.00 178.15 177.33 3hk9 h ASN 335 N 0.88 -0.12 -0.10 1.72 -1.24 -1.27 -0.17 115.58 115.28 3hk9 h ASN 335 Ca 0.35 -0.08 -0.10 0.00 0.71 0.00 0.00 56.30 57.18 3hk9 h ASN 335 Cb 0.18 0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.24 3hk9 h ASN 335 CO -0.18 0.01 -0.24 1.05 -1.29 0.00 0.00 177.43 176.78 3hk9 h GLU 336 N -0.24 0.54 -0.09 6.67 4.11 -1.31 -1.97 114.58 122.28 3hk9 h GLU 336 Ca -0.01 -0.20 -0.02 0.00 0.07 0.00 0.00 59.36 59.19 3hk9 h GLU 336 Cb 0.20 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 3hk9 h GLU 336 CO 0.02 0.74 -0.02 0.52 0.07 0.00 0.00 179.01 180.34 3hk9 h MET 337 N 0.48 0.18 -0.57 1.06 2.86 -0.80 -1.87 114.93 116.25 3hk9 h MET 337 Ca 0.07 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 3hk9 h MET 337 Cb 0.68 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 3hk9 h MET 337 CO 0.05 0.49 0.22 1.15 1.06 0.00 0.00 176.91 179.87 3hk9 h THR 338 N -0.15 1.21 -0.27 2.22 2.02 -0.97 -0.93 112.91 116.05 3hk9 h THR 338 Ca 0.02 -0.68 -0.17 0.00 0.77 0.00 0.00 66.41 66.36 3hk9 h THR 338 Cb 0.42 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 3hk9 h THR 338 CO 0.01 0.27 -0.48 0.03 0.37 0.00 0.00 175.52 175.72 3hk9 h ARG 339 N 0.83 0.79 -0.61 6.66 3.08 -1.32 -1.38 114.38 122.43 3hk9 h ARG 339 Ca 0.19 -0.50 -0.05 0.00 0.07 0.00 0.00 59.98 59.70 3hk9 h ARG 339 Cb 0.18 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 3hk9 h ARG 339 CO -0.02 1.13 0.19 0.52 -1.07 0.00 0.00 179.97 180.72 3hk9 h MET 340 N 0.55 0.96 -0.16 0.04 2.86 -1.09 -1.49 114.93 116.59 3hk9 h MET 340 Ca 0.02 -0.21 -0.00 0.00 -2.06 0.00 0.00 59.70 57.44 3hk9 h MET 340 Cb 1.08 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 3hk9 h MET 340 CO 0.11 0.85 0.09 0.00 1.06 0.00 0.00 176.91 179.02 3hk9 h ARG 341 N 0.88 0.22 -0.11 1.72 3.08 -1.13 -2.22 114.38 116.82 3hk9 h ARG 341 Ca 0.20 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 60.09 3hk9 h ARG 341 Cb 0.30 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3hk9 h ARG 341 CO -0.01 0.23 -0.49 1.98 -1.07 0.00 0.00 179.97 180.62 3hk9 h MET 342 N 0.15 0.28 -0.08 0.04 4.05 -1.18 0.21 114.93 118.40 3hk9 h MET 342 Ca 0.06 -0.16 -0.09 0.00 -0.28 0.00 0.00 59.70 59.22 3hk9 h MET 342 Cb 0.08 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 3hk9 h MET 342 CO -0.01 0.72 -0.37 0.93 0.23 0.00 0.00 176.91 178.40 3hk9 h GLU 343 N 0.23 0.17 0.00 0.39 5.08 -1.14 0.30 114.58 119.60 3hk9 h GLU 343 Ca 0.01 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3hk9 h GLU 343 Cb 0.95 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.20 3hk9 h GLU 343 CO 0.08 0.52 -1.35 -1.33 -1.00 0.00 0.00 179.01 175.93 3hk9 n MET 344 N -4.07 0.96 0.00 2.33 2.81 -0.85 -4.63 117.12 113.68 3hk9 n MET 344 Ca -0.01 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.79 3hk9 n MET 344 Cb 0.44 -1.35 0.00 0.00 -0.71 0.00 0.00 33.22 31.60 3hk9 n MET 344 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3hk9 n LEU 345 N -1.79 0.86 0.00 4.03 4.77 0.73 -4.90 117.00 120.69 3hk9 n LEU 345 Ca -0.00 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 3hk9 n LEU 345 Cb 0.36 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 3hk9 n LEU 345 CO 0.35 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 3hk9 n GLY 346 N -0.12 3.87 0.70 -0.72 0.00 0.09 -0.89 105.19 108.12 3hk9 n GLY 346 Ca 0.00 0.20 0.06 0.00 0.00 0.00 0.00 46.02 46.29 3hk9 n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hk9 n THR 347 N 0.00 1.46 -1.10 2.61 -2.24 -1.26 -4.25 114.28 109.50 3hk9 n THR 347 Ca 0.00 -1.32 -0.15 0.00 -2.27 0.00 0.00 64.05 60.31 3hk9 n THR 347 Cb 0.00 0.23 -0.13 0.00 -2.10 0.00 0.00 70.33 68.33 3hk9 n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3hk9 n SER 348 N 0.10 5.56 -3.53 3.42 3.41 -0.07 -4.73 113.62 117.79 3hk9 n SER 348 Ca 0.15 -2.66 -0.09 0.00 -0.26 0.00 0.00 58.87 56.00 3hk9 n SER 348 Cb 0.58 -1.36 -0.02 0.00 -0.26 0.00 0.00 64.21 63.16 3hk9 n SER 348 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3hk9 s PHE 349 N 0.26 0.24 -0.34 7.33 -0.12 -1.26 -4.84 117.98 119.24 3hk9 s PHE 349 Ca 0.62 -0.70 -0.02 0.00 -0.05 0.00 0.00 56.93 56.77 3hk9 s PHE 349 Cb 0.32 0.49 0.07 0.00 -0.63 0.00 0.00 43.02 43.28 3hk9 s PHE 349 CO -0.05 -1.26 0.08 0.42 -0.05 0.00 0.00 175.22 174.36 3hk9 s ILE 350 N -3.34 3.11 0.23 -4.49 1.01 -1.02 -4.66 121.20 112.05 3hk9 s ILE 350 Ca 0.18 -1.66 -0.07 0.00 0.00 0.00 0.00 60.65 59.10 3hk9 s ILE 350 Cb -0.03 -2.94 0.20 0.00 0.01 0.00 0.00 42.46 39.69 3hk9 s ILE 350 CO 0.11 -0.35 1.84 1.55 0.00 0.00 0.00 174.94 178.09 3hk9 h PRO 351 N 8.01 1.24 -3.73 2.79 0.13 -1.86 -0.97 132.00 137.61 3hk9 h PRO 351 Ca -0.17 -0.17 -0.08 0.00 -0.87 0.00 0.00 66.00 64.71 3hk9 h PRO 351 Cb 1.06 -0.23 -0.12 0.00 0.13 0.00 0.00 31.00 31.83 3hk9 h PRO 351 CO 0.60 0.93 -0.24 -1.14 -0.23 0.00 0.00 178.00 177.91 3hk9 s GLN 352 N -5.75 1.14 0.04 0.86 2.00 -1.26 -3.15 119.66 113.54 3hk9 s GLN 352 Ca -0.13 -1.05 -0.11 0.00 -2.00 0.00 0.00 55.36 52.08 3hk9 s GLN 352 Cb 0.17 0.41 0.01 0.00 0.80 0.00 0.00 33.01 34.39 3hk9 s GLN 352 CO 0.83 -0.43 0.23 -3.38 -0.50 0.00 0.00 175.29 172.05 3hk9 s HIS 353 N -3.92 -0.01 0.02 1.67 -3.43 -1.26 -4.59 115.29 103.77 3hk9 s HIS 353 Ca 0.13 -0.17 0.03 0.00 -0.80 0.00 0.00 55.06 54.25 3hk9 s HIS 353 Cb 0.03 0.02 -0.25 0.00 -1.43 0.00 0.00 32.58 30.95 3hk9 s HIS 353 CO -0.03 -0.45 0.89 0.66 -2.00 0.00 0.00 174.74 173.81 3hk9 h SER 354 N 3.42 0.19 -1.45 7.38 4.64 -1.93 -3.44 113.55 122.36 3hk9 h SER 354 Ca -0.32 -0.28 -0.39 0.00 -0.47 0.00 0.00 61.79 60.33 3hk9 h SER 354 Cb 1.19 -0.06 -0.12 0.00 -0.31 0.00 0.00 62.40 63.10 3hk9 h SER 354 CO 0.47 1.24 -0.40 -0.67 -0.87 0.00 0.00 176.83 176.60 3hk9 n ASP 355 N -3.32 -5.38 -4.66 4.97 -0.08 -0.15 -4.87 116.55 103.05 3hk9 n ASP 355 Ca -0.13 0.33 -0.46 0.00 -1.51 0.00 0.00 54.79 53.02 3hk9 n ASP 355 Cb 1.02 -4.53 -0.04 0.00 2.34 0.00 0.00 41.12 39.91 3hk9 n ASP 355 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hk9 n ALA 356 N 0.40 1.11 -0.02 -1.67 0.00 -1.26 -4.40 120.51 114.67 3hk9 n ALA 356 Ca -0.20 0.45 0.04 0.00 0.00 0.00 0.00 53.44 53.73 3hk9 n ALA 356 Cb 0.64 -2.32 -0.12 0.00 0.00 0.00 0.00 19.45 17.66 3hk9 n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hk9 n ARG 357 N 3.23 0.74 -4.90 0.00 1.74 -1.26 0.82 116.66 117.03 3hk9 n ARG 357 Ca 0.17 -0.11 -0.29 0.00 -0.77 0.00 0.00 57.85 56.85 3hk9 n ARG 357 Cb 0.28 -1.37 -0.17 0.00 -1.02 0.00 0.00 32.46 30.18 3hk9 n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3hk9 s VAL 358 N -2.91 1.63 0.22 1.55 1.01 -1.26 -4.40 120.40 116.23 3hk9 s VAL 358 Ca -0.06 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 60.96 3hk9 s VAL 358 Cb 0.09 -1.44 0.20 0.00 0.00 0.00 0.00 36.38 35.23 3hk9 s VAL 358 CO 0.64 0.47 1.55 0.25 0.00 0.00 0.00 175.10 178.00 3hk9 h LEU 359 N 6.87 -1.51 -2.78 3.92 5.85 -1.48 -0.74 115.31 125.43 3hk9 h LEU 359 Ca -0.25 0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3hk9 h LEU 359 Cb 1.21 0.77 -0.00 0.00 0.37 0.00 0.00 40.66 43.02 3hk9 h LEU 359 CO 0.47 -0.28 0.06 -0.33 -0.34 0.00 0.00 178.44 178.02 3hk9 h GLU 360 N -0.01 0.00 0.00 1.25 3.07 -1.94 -2.40 114.58 114.55 3hk9 h GLU 360 Ca 0.32 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.18 3hk9 h GLU 360 Cb 0.58 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.49 3hk9 h GLU 360 CO -0.98 0.00 -0.01 1.96 -1.40 0.00 0.00 179.01 178.58 3hk9 h GLN 361 N 0.00 0.00 -0.67 2.33 4.20 -1.53 -1.40 115.11 118.03 3hk9 h GLN 361 Ca 0.00 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.84 3hk9 h GLN 361 Cb 0.12 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.86 3hk9 h GLN 361 CO -0.00 0.01 0.45 -0.07 -0.67 0.00 0.00 178.83 178.55 3hk9 h LEU 362 N 0.00 0.36 0.78 1.46 3.38 -1.60 0.77 115.31 120.45 3hk9 h LEU 362 Ca -0.00 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3hk9 h LEU 362 Cb 0.11 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.81 3hk9 h LEU 362 CO 0.00 0.20 -0.37 0.40 0.09 0.00 0.00 178.44 178.76 3hk9 h ILE 363 N 0.39 0.00 -0.34 1.22 2.04 -1.49 -2.87 117.51 116.45 3hk9 h ILE 363 Ca 0.32 -0.11 -0.17 0.00 1.00 0.00 0.00 64.86 65.91 3hk9 h ILE 363 Cb 0.72 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3hk9 h ILE 363 CO -0.09 0.00 -0.44 0.10 0.00 0.00 0.00 178.15 177.71 3hk9 h TYR 364 N -1.15 1.09 -0.47 1.37 -0.00 -1.60 -0.88 116.97 115.33 3hk9 h TYR 364 Ca -0.11 -0.35 0.06 0.00 0.00 0.00 0.00 58.73 58.33 3hk9 h TYR 364 Cb 0.80 -0.22 -0.05 0.00 0.00 0.00 0.00 36.73 37.26 3hk9 h TYR 364 CO 0.03 1.17 0.18 0.87 -0.00 0.00 0.00 178.16 180.41 3hk9 h LYS 365 N 0.72 0.36 0.08 0.10 1.79 -0.96 0.11 116.57 118.76 3hk9 h LYS 365 Ca 0.04 -0.02 -0.25 0.00 -2.18 0.00 0.00 60.65 58.24 3hk9 h LYS 365 Cb 1.04 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.61 3hk9 h LYS 365 CO 0.10 0.24 -1.12 -1.49 -1.08 0.00 0.00 179.45 176.10 3hk9 h TRP 366 N 0.37 0.49 0.32 -1.35 4.06 -1.52 -2.57 115.95 115.75 3hk9 h TRP 366 Ca 0.22 -0.32 -0.02 0.00 2.06 0.00 0.00 58.89 60.83 3hk9 h TRP 366 Cb 0.20 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.33 3hk9 h TRP 366 CO -0.14 1.21 -0.15 1.25 -3.56 0.00 0.00 178.44 177.04 3hk9 h HIS 367 N 0.11 -0.40 -0.85 0.49 2.76 -0.85 0.19 115.15 116.61 3hk9 h HIS 367 Ca -0.11 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.06 3hk9 h HIS 367 Cb 1.82 0.13 -0.04 0.00 1.55 0.00 0.00 27.41 30.87 3hk9 h HIS 367 CO 0.06 -0.16 0.55 0.45 -1.30 0.00 0.00 177.93 177.53 3hk9 h HIS 368 N -0.58 1.08 -0.10 5.26 3.86 -0.89 -2.67 115.15 121.11 3hk9 h HIS 368 Ca -0.04 0.02 -0.23 0.00 -1.16 0.00 0.00 60.37 58.96 3hk9 h HIS 368 Cb 0.42 -0.36 0.01 0.00 1.06 0.00 0.00 27.41 28.54 3hk9 h HIS 368 CO -0.02 0.69 -0.84 0.77 0.86 0.00 0.00 177.93 179.39 3hk9 h SER 369 N 1.15 0.85 -0.64 2.45 0.02 -1.40 -3.20 113.55 112.79 3hk9 h SER 369 Ca 0.31 -0.59 -0.03 0.00 -0.84 0.00 0.00 61.79 60.64 3hk9 h SER 369 Cb -0.11 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.14 3hk9 h SER 369 CO -0.06 1.38 0.30 0.11 -1.14 0.00 0.00 176.83 177.42 3hk9 h LYS 370 N 0.46 0.95 -0.51 3.45 1.57 -0.54 -0.71 116.57 121.23 3hk9 h LYS 370 Ca -0.07 -0.13 -0.07 0.00 -1.87 0.00 0.00 60.65 58.51 3hk9 h LYS 370 Cb 1.47 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.58 3hk9 h LYS 370 CO 0.17 0.74 0.05 0.66 -0.57 0.00 0.00 179.45 180.50 3hk9 h SER 371 N 0.94 0.79 -0.05 0.86 4.64 -1.50 0.67 113.55 119.90 3hk9 h SER 371 Ca 0.23 -0.18 -0.05 0.00 -0.47 0.00 0.00 61.79 61.33 3hk9 h SER 371 Cb 0.12 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 3hk9 h SER 371 CO -0.03 0.83 -0.15 0.40 -0.87 0.00 0.00 176.83 177.01 3hk9 h ILE 372 N 0.78 1.44 -0.69 0.95 2.04 -1.46 -2.63 117.51 117.94 3hk9 h ILE 372 Ca 0.16 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.49 3hk9 h ILE 372 Cb 0.40 2.32 -0.03 0.00 -0.74 0.00 0.00 36.82 38.77 3hk9 h ILE 372 CO 0.01 0.42 0.44 0.40 0.00 0.00 0.00 178.15 179.43 3hk9 h ILE 373 N -0.34 1.18 -0.45 -0.67 2.04 -1.04 -1.81 117.51 116.43 3hk9 h ILE 373 Ca -0.00 -0.36 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 3hk9 h ILE 373 Cb 0.76 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3hk9 h ILE 373 CO 0.03 0.18 0.21 0.00 0.00 0.00 0.00 178.15 178.58 3hk9 h ALA 374 N 1.54 0.58 -0.76 1.87 0.00 -0.84 -1.55 119.26 120.11 3hk9 h ALA 374 Ca 0.25 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3hk9 h ALA 374 Cb -0.08 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 3hk9 h ALA 374 CO -0.05 0.15 0.47 0.93 0.00 0.00 0.00 179.25 180.75 3hk9 h GLU 375 N 0.58 1.02 0.00 0.00 4.39 -0.97 -0.42 114.58 119.19 3hk9 h GLU 375 Ca 0.15 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 3hk9 h GLU 375 Cb 0.13 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 3hk9 h GLU 375 CO -0.02 0.71 -0.00 0.28 -1.16 0.00 0.00 179.01 178.82 3hk9 h VAL 376 N 1.03 1.01 -0.65 3.13 2.07 -1.07 -2.07 116.25 119.71 3hk9 h VAL 376 Ca 0.27 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.79 3hk9 h VAL 376 Cb -0.06 1.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 3hk9 h VAL 376 CO -0.05 0.01 0.38 -0.07 0.02 0.00 0.00 177.57 177.85 3hk9 h LEU 377 N -0.02 0.58 -0.64 2.57 3.38 -0.93 -0.80 115.31 119.45 3hk9 h LEU 377 Ca -0.00 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.04 3hk9 h LEU 377 Cb 0.02 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 3hk9 h LEU 377 CO 0.00 0.39 0.35 0.40 0.09 0.00 0.00 178.44 179.67 3hk9 h ILE 378 N 0.72 0.97 -0.10 1.22 2.04 -0.86 0.18 117.51 121.67 3hk9 h ILE 378 Ca 0.28 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 3hk9 h ILE 378 Cb 0.11 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 36.44 3hk9 h ILE 378 CO -0.15 0.12 0.04 0.44 0.00 0.00 0.00 178.15 178.60 3hk9 h ASP 379 N 0.65 0.13 -0.77 1.72 3.32 -0.63 -0.17 116.42 120.67 3hk9 h ASP 379 Ca 0.28 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 3hk9 h ASP 379 Cb 0.17 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 3hk9 h ASP 379 CO -0.18 0.27 0.34 0.11 -1.72 0.00 0.00 179.24 178.06 3hk9 h LYS 380 N -0.01 1.14 -0.22 3.56 6.56 -0.68 -0.83 116.57 126.10 3hk9 h LYS 380 Ca 0.03 -0.19 -0.13 0.00 -1.06 0.00 0.00 60.65 59.31 3hk9 h LYS 380 Cb 0.18 -0.20 -0.01 0.00 -0.57 0.00 0.00 32.23 31.63 3hk9 h LYS 380 CO -0.00 0.90 -0.42 1.88 -2.06 0.00 0.00 179.45 179.76 3hk9 h TYR 381 N 1.12 0.61 -0.58 -1.35 0.05 -0.60 -2.88 116.97 113.35 3hk9 h TYR 381 Ca 0.26 -0.18 -0.08 0.00 0.05 0.00 0.00 58.73 58.79 3hk9 h TYR 381 Cb 0.17 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 3hk9 h TYR 381 CO 0.02 0.85 0.07 0.22 -1.05 0.00 0.00 178.16 178.27 3hk9 h ASP 382 N 0.42 0.95 -0.83 3.88 3.58 -0.46 -0.06 116.42 123.90 3hk9 h ASP 382 Ca 0.03 -0.27 -0.02 0.00 0.42 0.00 0.00 57.03 57.19 3hk9 h ASP 382 Cb 0.91 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 41.67 3hk9 h ASP 382 CO 0.08 0.98 0.44 0.44 -2.88 0.00 0.00 179.24 178.30 3hk9 h ASP 383 N 0.88 1.06 1.26 2.28 3.32 -1.04 0.10 116.42 124.28 3hk9 h ASP 383 Ca 0.17 -0.10 -0.14 0.00 0.02 0.00 0.00 57.03 56.98 3hk9 h ASP 383 Cb 0.45 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 3hk9 h ASP 383 CO 0.02 0.86 -0.69 0.16 -1.72 0.00 0.00 179.24 177.87 3hk9 h ILE 384 N 1.18 1.20 -0.70 0.35 3.07 -1.32 -2.00 117.51 119.28 3hk9 h ILE 384 Ca 0.29 -2.65 -0.07 0.00 1.55 0.00 0.00 64.86 63.98 3hk9 h ILE 384 Cb 0.06 2.56 -0.03 0.00 -0.27 0.00 0.00 36.82 39.14 3hk9 h ILE 384 CO -0.04 0.67 0.15 -0.07 -1.05 0.00 0.00 178.15 177.81 3hk9 h LEU 385 N 0.00 1.09 -1.53 0.16 -0.00 -0.53 -0.19 115.31 114.30 3hk9 h LEU 385 Ca -0.01 -0.24 -0.04 0.00 -0.00 0.00 0.00 57.88 57.59 3hk9 h LEU 385 Cb 1.50 -0.29 -0.01 0.00 -0.00 0.00 0.00 40.66 41.87 3hk9 h LEU 385 CO 0.09 1.05 -0.12 -0.61 -0.00 0.00 0.00 178.44 178.86 3hk9 h GLN 386 N 1.07 0.16 -0.04 1.13 5.75 -0.61 -1.08 115.11 121.48 3hk9 h GLN 386 Ca 0.22 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.69 3hk9 h GLN 386 Cb 0.41 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.93 3hk9 h GLN 386 CO 0.01 0.28 0.00 0.00 -2.65 0.00 0.00 178.83 176.47 3hk9 n ALA 387 N -2.50 2.56 -0.23 3.38 0.00 -0.77 -4.87 120.51 118.08 3hk9 n ALA 387 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3hk9 n ALA 387 Cb 0.24 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.51 3hk9 n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hk9 n GLY 388 N 0.78 0.66 3.76 0.00 0.00 -0.41 -5.06 105.19 104.91 3hk9 n GLY 388 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 3hk9 n GLY 388 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3hk9 s TRP 389 N -2.38 3.81 -0.76 1.61 -0.11 -0.16 -4.99 118.94 115.96 3hk9 s TRP 389 Ca 0.00 1.83 -0.10 0.00 1.22 0.00 0.00 56.10 59.05 3hk9 s TRP 389 Cb 0.00 -3.04 0.20 0.00 -1.50 0.00 0.00 33.47 29.13 3hk9 s TRP 389 CO 0.00 0.14 0.66 -2.00 -4.62 0.00 0.00 176.95 171.13 3hk9 s GLU 390 N -1.46 3.27 0.26 5.86 2.12 -1.26 -4.16 118.70 123.33 3hk9 s GLU 390 Ca 0.44 -2.49 -0.30 0.00 0.36 0.00 0.00 54.97 52.99 3hk9 s GLU 390 Cb -0.26 -4.20 -0.09 0.00 0.26 0.00 0.00 34.13 29.84 3hk9 s GLU 390 CO 0.32 -1.25 1.03 0.14 -0.54 0.00 0.00 175.26 174.96 3hk9 s VAL 391 N 0.08 3.73 0.29 3.70 -7.23 -1.26 -5.04 120.40 114.67 3hk9 s VAL 391 Ca 0.18 1.74 0.07 0.00 -1.81 0.00 0.00 61.98 62.16 3hk9 s VAL 391 Cb -0.13 -4.11 -0.03 0.00 0.56 0.00 0.00 36.38 32.66 3hk9 s VAL 391 CO -0.07 0.42 0.24 0.42 -0.31 0.00 0.00 175.10 175.79 3hk9 s THR 392 N -1.16 4.06 0.39 5.32 -4.23 -1.26 -4.56 115.64 114.20 3hk9 s THR 392 Ca 0.43 -1.39 0.11 0.00 -1.18 0.00 0.00 61.69 59.66 3hk9 s THR 392 Cb -0.29 -3.31 0.15 0.00 1.34 0.00 0.00 72.50 70.38 3hk9 s THR 392 CO 0.37 -0.28 1.90 -0.08 -0.54 0.00 0.00 174.62 176.00 3hk9 h GLU 393 N 1.39 0.16 -0.20 3.99 4.81 -1.99 -2.51 114.58 120.22 3hk9 h GLU 393 Ca -0.47 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 58.59 3hk9 h GLU 393 Cb 1.25 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 3hk9 h GLU 393 CO 0.60 0.36 -0.41 0.93 -0.73 0.00 0.00 179.01 179.75 3hk9 h GLU 394 N 0.15 0.48 -0.24 1.92 4.39 -1.99 -1.44 114.58 117.86 3hk9 h GLU 394 Ca 0.03 -0.24 -0.14 0.00 0.34 0.00 0.00 59.36 59.35 3hk9 h GLU 394 Cb 0.43 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 3hk9 h GLU 394 CO 0.03 0.81 -0.43 0.93 -1.16 0.00 0.00 179.01 179.19 3hk9 h GLU 395 N 0.39 0.59 -0.52 2.33 5.08 -1.88 -1.60 114.58 118.97 3hk9 h GLU 395 Ca 0.03 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.04 3hk9 h GLU 395 Cb 0.89 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 3hk9 h GLU 395 CO 0.08 0.91 0.16 0.82 -1.00 0.00 0.00 179.01 179.97 3hk9 h ILE 396 N 0.48 1.23 -0.70 3.13 2.04 -1.23 0.72 117.51 123.17 3hk9 h ILE 396 Ca 0.04 -0.78 -0.00 0.00 1.00 0.00 0.00 64.86 65.11 3hk9 h ILE 396 Cb 0.95 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 3hk9 h ILE 396 CO 0.08 0.29 0.43 0.11 0.00 0.00 0.00 178.15 179.06 3hk9 h LYS 397 N 0.71 0.95 0.10 2.37 1.79 -1.04 -0.01 116.57 121.45 3hk9 h LYS 397 Ca 0.17 -0.08 -0.01 0.00 -2.18 0.00 0.00 60.65 58.55 3hk9 h LYS 397 Cb 0.28 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 3hk9 h LYS 397 CO -0.00 0.67 -0.05 -0.09 -1.08 0.00 0.00 179.45 178.90 3hk9 h ARG 398 N 0.96 -0.13 -0.45 3.15 2.43 -0.91 -0.53 114.38 118.90 3hk9 h ARG 398 Ca 0.25 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.49 3hk9 h ARG 398 Cb -0.04 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.49 3hk9 h ARG 398 CO -0.05 -0.00 0.16 -0.44 -1.51 0.00 0.00 179.97 178.13 3hk9 h ASP 399 N -0.24 0.16 -0.62 -3.80 3.32 -0.60 -1.13 116.42 113.52 3hk9 h ASP 399 Ca -0.01 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 3hk9 h ASP 399 Cb 0.19 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 3hk9 h ASP 399 CO 0.02 0.12 0.27 0.58 -1.72 0.00 0.00 179.24 178.51 3hk9 h VAL 400 N 0.33 1.22 -0.54 -1.35 2.07 -0.87 -2.33 116.25 114.79 3hk9 h VAL 400 Ca 0.21 -0.69 -0.05 0.00 0.82 0.00 0.00 66.70 67.00 3hk9 h VAL 400 Cb 0.21 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 3hk9 h VAL 400 CO -0.22 0.28 0.16 0.00 0.02 0.00 0.00 177.57 177.81 3hk9 h ALA 401 N 1.36 0.70 -0.07 1.67 0.00 -0.32 -1.98 119.26 120.62 3hk9 h ALA 401 Ca 0.22 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3hk9 h ALA 401 Cb 0.17 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3hk9 h ALA 401 CO -0.02 0.38 -0.02 -0.44 0.00 0.00 0.00 179.25 179.15 3hk9 h ASP 402 N 0.75 -0.06 -0.38 0.00 3.32 -0.78 0.57 116.42 119.83 3hk9 h ASP 402 Ca 0.17 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.23 3hk9 h ASP 402 Cb 0.30 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 3hk9 h ASP 402 CO -0.00 -0.02 0.17 -0.07 -1.72 0.00 0.00 179.24 177.60 3hk9 h LEU 403 N 0.00 0.51 0.00 1.55 3.38 -1.34 0.27 115.31 119.68 3hk9 h LEU 403 Ca 0.03 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3hk9 h LEU 403 Cb 0.05 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3hk9 h LEU 403 CO -0.07 0.51 -0.53 0.49 0.09 0.00 0.00 178.44 178.92 3hk9 n PHE 404 N -4.69 0.18 0.18 1.13 3.72 -0.75 -4.26 117.46 112.96 3hk9 n PHE 404 Ca -0.00 0.05 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 3hk9 n PHE 404 Cb 0.12 -0.39 0.00 0.00 -0.94 0.00 0.00 39.48 38.27 3hk9 n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3hk9 n SER 405 N -1.70 -2.47 -0.31 4.37 2.88 0.00 -1.40 113.62 114.99 3hk9 n SER 405 Ca 0.05 0.67 -0.02 0.00 -1.33 0.00 0.00 58.87 58.23 3hk9 n SER 405 Cb 0.37 2.41 0.10 0.00 -0.75 0.00 0.00 64.21 66.34 3hk9 n SER 405 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 3hk9 h ARG 406 N 0.00 1.06 -0.90 -1.46 3.08 -1.04 -2.78 114.38 112.35 3hk9 h ARG 406 Ca 0.00 -0.06 0.14 0.00 0.07 0.00 0.00 59.98 60.13 3hk9 h ARG 406 Cb 0.00 -0.24 -0.07 0.00 0.08 0.00 0.00 29.97 29.74 3hk9 h ARG 406 CO 0.00 0.70 0.58 -0.91 -1.07 0.00 0.00 179.97 179.27 3hk9 h ASN 407 N 1.10 0.68 0.17 7.04 2.35 -0.67 0.13 115.58 126.38 3hk9 h ASN 407 Ca 0.33 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 56.11 3hk9 h ASN 407 Cb -0.05 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.23 3hk9 h ASN 407 CO -0.10 0.35 -0.08 0.15 -1.65 0.00 0.00 177.43 176.10 3hk9 h PHE 408 N 0.72 -0.21 -0.36 1.19 3.57 -1.70 -2.36 116.94 117.79 3hk9 h PHE 408 Ca 0.45 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.90 3hk9 h PHE 408 Cb 0.69 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 3hk9 h PHE 408 CO -0.00 0.17 0.05 -1.49 -2.23 0.00 0.00 178.31 174.81 3hk9 h TRP 409 N -0.64 0.55 -0.31 0.41 4.06 -1.39 -0.64 115.95 117.98 3hk9 h TRP 409 Ca -0.02 -0.04 -0.10 0.00 2.06 0.00 0.00 58.89 60.79 3hk9 h TRP 409 Cb 0.47 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.45 3hk9 h TRP 409 CO 0.05 0.50 -0.22 -0.09 -3.56 0.00 0.00 178.44 175.12 3hk9 h ARG 410 N 0.52 0.60 -0.02 0.49 2.43 -1.01 -0.62 114.38 116.77 3hk9 h ARG 410 Ca 0.12 -0.22 -0.15 0.00 -0.81 0.00 0.00 59.98 58.91 3hk9 h ARG 410 Cb 0.26 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3hk9 h ARG 410 CO 0.00 0.78 -0.58 0.35 -1.51 0.00 0.00 179.97 179.01 3hk9 h PHE 411 N 0.53 0.61 0.00 2.20 3.57 -0.79 -3.14 116.94 119.92 3hk9 h PHE 411 Ca 0.08 -0.32 0.00 0.00 3.53 0.00 0.00 57.97 61.26 3hk9 h PHE 411 Cb 0.67 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.34 3hk9 h PHE 411 CO 0.03 1.13 0.00 1.33 -2.23 0.00 0.00 178.31 178.57 3hk9 n VAL 412 N -4.23 0.25 -2.95 1.41 0.24 -0.32 -4.91 118.33 107.82 3hk9 n VAL 412 Ca -0.10 0.06 -0.12 0.00 -2.04 0.00 0.00 64.34 62.14 3hk9 n VAL 412 Cb 0.66 -0.64 0.06 0.00 -1.47 0.00 0.00 33.84 32.45 3hk9 n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hk9 n GLY 413 N 0.96 -0.45 0.00 7.63 0.00 -0.36 -4.85 105.19 108.12 3hk9 n GLY 413 Ca 0.09 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.31 3hk9 n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86